Cannabis Compound Database: Showing Compound Card for Acetyl-CoA (CDB005092)

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Identification Taxonomy Ontology Physical properties Spectra Protein target Pathways Concentrations Links References enzymes (158)transporters (8) Show 226 proteins XML

Record Information

Version

1.0

Created at

2020-04-17 19:08:31 UTC

Updated at

2020-12-07 19:11:33 UTC

CannabisDB ID

CDB005092

Secondary Accession Numbers

Not Available

Cannabis Compound Identification

Common Name

Acetyl-CoA

Description

Acetyl-CoA, also known as acetyl coenzyme A or accoa, belongs to the class of organic compounds known as o-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through an O-glycosidic bond. Thus, acetyl-CoA is considered to be a fatty ester lipid molecule. Acetyl-CoA is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. Acetyl-CoA exists in all living species, ranging from bacteria to humans. In humans, acetyl-CoA is involved in the metabolic disorder called the long chain acyl-coa dehydrogenase deficiency (lcad) pathway. An acyl-CoA having acetyl as its S-acetyl component. Outside of the human body, Acetyl-CoA has been detected, but not quantified in, several different foods, such as amaranths, lemon verbena, strawberries, lingonberries, and carobs. This could make acetyl-CoA a potential biomarker for the consumption of these foods. Acetyl-CoA is expected to be in Cannabis as all living plants are known to produce and metabolize it.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
AcCoA	ChEBI
Acetyl coenzyme A	ChEBI
S-Acetyl-CoA	ChEBI
S-Acetyl-coenzyme A	ChEBI
Ac-CoA	HMDB
Ac-coenzyme A	HMDB
Ac-S-CoA	HMDB
Ac-S-coenzyme A	HMDB
Acetyl-coenzyme A	HMDB
Acetyl-S-CoA	HMDB
Acetyl-S-coenzyme A	HMDB
Acetylcoenzyme A	HMDB
S-Acetate CoA	HMDB
S-Acetate coenzyme A	HMDB
S-Acetyl coenzyme A	HMDB
coenzyme A, Acetyl	HMDB
Acetyl CoA	HMDB
CoA, Acetyl	HMDB

Chemical Formula

C₂₃H₃₈N₇O₁₇P₃S

Average Molecular Weight

809.57

Monoisotopic Molecular Weight

809.1258

IUPAC Name

{[(2R,3S,4R,5R)-2-({[({[(3R)-3-[(2-{[2-(acetylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid

Traditional Name

acetyl-CoA

CAS Registry Number

72-89-9

SMILES

CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N

InChI Identifier

InChI=1S/C23H38N7O17P3S/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15-19(24)27-10-28-20(15)30/h10-11,13,16-18,22,33-34H,4-9H2,1-3H3,(H,25,32)(H,26,35)(H,39,40)(H,41,42)(H2,24,27,28)(H2,36,37,38)/t13-,16-,17-,18+,22-/m1/s1

InChI Key

ZSLZBFCDCINBPY-ZSJPKINUSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as o-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through an O-glycosidic bond.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

O-glucuronides

Alternative Parents

Substituents

1-o-glucuronide
O-glucuronide
Glycosyl compound
O-glycosyl compound
Pyrrolidinylpyridine
Alkaloid or derivatives
Beta-hydroxy acid
Hydroxy acid
Monosaccharide
Oxane
Pyran
Pyridine
Pyrrolidone
2-pyrrolidone
N-alkylpyrrolidine
Pyrrolidine
Tertiary carboxylic acid amide
Heteroaromatic compound
Secondary alcohol
Carboxamide group
Lactam
Azacycle
Organoheterocyclic compound
Carboxylic acid
Oxacycle
Carboxylic acid derivative
Polyol
Acetal
Monocarboxylic acid or derivatives
Organopnictogen compound
Organic nitrogen compound
Carbonyl group
Alcohol
Organic oxide
Hydrocarbon derivative
Organonitrogen compound
Aromatic heteromonocyclic compound

Molecular Framework

Aromatic heteromonocyclic compounds

External Descriptors

Not Available

Ontology

Disposition

Route of exposure:

Enteral:

Ingestion

Source:

Biological:

Animal

Plant:

Biological location:

Role

Industrial application:

Biological role:

Physical Properties

State

Solid

Experimental Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
logP	Not Available	Not Available

Predicted Properties

Property	Value	Source
logP	-0.58	ALOGPS
logP	-5.9	ChemAxon
logS	-2.3	ALOGPS
pKa (Strongest Acidic)	0.82	ChemAxon
pKa (Strongest Basic)	4.01	ChemAxon
Physiological Charge	-4	ChemAxon
Hydrogen Acceptor Count	17	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	363.63 Å²	ChemAxon
Rotatable Bond Count	20	ChemAxon
Refractivity	172.21 m³·mol⁻¹	ChemAxon
Polarizability	70.62 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Spectra

EI-MS/GC-MS

Type	Description	Splash Key	View
Predicted GC-MS	Acetyl-CoA, TMS_1_1, Predicted GC-MS Spectrum - 70eV, Positive	Not Available	Spectrum
Predicted GC-MS	Acetyl-CoA, TMS_1_2, Predicted GC-MS Spectrum - 70eV, Positive	Not Available	Spectrum
Predicted GC-MS	Acetyl-CoA, TMS_1_3, Predicted GC-MS Spectrum - 70eV, Positive	Not Available	Spectrum
Predicted GC-MS	Acetyl-CoA, TMS_1_4, Predicted GC-MS Spectrum - 70eV, Positive	Not Available	Spectrum
Predicted GC-MS	Acetyl-CoA, TMS_1_5, Predicted GC-MS Spectrum - 70eV, Positive	Not Available	Spectrum
Predicted GC-MS	Acetyl-CoA, TMS_1_6, Predicted GC-MS Spectrum - 70eV, Positive	Not Available	Spectrum
Predicted GC-MS	Acetyl-CoA, TMS_1_7, Predicted GC-MS Spectrum - 70eV, Positive	Not Available	Spectrum
Predicted GC-MS	Acetyl-CoA, TMS_1_8, Predicted GC-MS Spectrum - 70eV, Positive	Not Available	Spectrum

MS/MS

Type	Description	Splash Key	View
MS/MS	LC-MS/MS Spectrum - LC-ESI-ITFT 35V, positive	splash10-0fb9-0035910000-cecfaf54528fc3ef9f00	2020-07-21	View Spectrum
MS/MS	LC-MS/MS Spectrum - LC-ESI-ITFT 35V, positive	splash10-0ufr-0005900000-491971eb7a5c2b327554	2020-07-21	View Spectrum
MS/MS	LC-MS/MS Spectrum - LC-ESI-ITFT 35V, negative	splash10-0a4i-0900000000-1b259612c3897ed851f0	2020-07-21	View Spectrum
MS/MS	LC-MS/MS Spectrum - LC-ESI-ITFT 35V, negative	splash10-08i0-0001901200-8d4f5232c27f2875cf8b	2020-07-21	View Spectrum
MS/MS	LC-MS/MS Spectrum - LC-ESI-ITFT 35V, negative	splash10-08i0-0000901200-33f8d3ced8c83336df0c	2020-07-21	View Spectrum
MS/MS	LC-MS/MS Spectrum - 33V, Negative	splash10-0a4i-1101800090-5031dc04edf8ba0f3afb	2021-09-20	View Spectrum
MS/MS	LC-MS/MS Spectrum - 33V, Negative	splash10-0a4i-1101900080-6691464da5a030f7d086	2021-09-20	View Spectrum
MS/MS	LC-MS/MS Spectrum - 33V, Negative	splash10-0a4i-1101900080-8a1491c56fc1331c5df1	2021-09-20	View Spectrum
MS/MS	LC-MS/MS Spectrum - 33V, Negative	splash10-0a4i-1101900080-9ec3eecc20f19a822002	2021-09-20	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-000i-1901000300-57c996f08055dba75dd7	2015-09-15	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-000i-0902000000-dffb00601bfc54014ae4	2015-09-15	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-000i-2901000000-155f0890adf4c76dca85	2015-09-15	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 10V, Negative	splash10-0arr-6820231930-984ae0f98e0d17e4a7fc	2015-09-15	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 20V, Negative	splash10-003r-3910100000-87da6b6d742efbc6e74a	2015-09-15	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 40V, Negative	splash10-057i-5900000000-8701decc3b2311880b97	2015-09-15	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 10V, Negative	splash10-0a4i-0000000090-fd17a06b039262f96463	2021-09-22	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 20V, Negative	splash10-05vx-9100203430-9e39d5da3afdd3a15f91	2021-09-22	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 40V, Negative	splash10-00b9-9101401200-719cb55952a06d96d3c8	2021-09-22	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-03di-0000000090-02de4c2ee732e6d50b2d	2021-09-23	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-01p9-1901002440-79ee9e61778bd08a750f	2021-09-23	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-0udi-0209000000-84f7f68fc2e83a8ae770	2021-09-23	View Spectrum

NMR

Not Available

Pathways

Name	SMPDB/Pathwhiz	KEGG
Butyrate Metabolism
Fatty acid Metabolism
Valine, Leucine and Isoleucine Degradation
Citric Acid Cycle
Propanoate Metabolism

Protein Targets

Enzymes

Protein Name	Gene Name	Locus	Uniprot ID	Details
Hydroxymethylglutaryl-CoA lyase, mitochondrial	HMGCL	1p36.1-p35	P35914	details
ATP-citrate synthase	ACLY	17q21.2	P53396	details
Histone acetyltransferase p300	EP300	22q13.2	Q09472	details
Pyruvate dehydrogenase E1 component subunit beta, mitochondrial	PDHB	3p21.1-p14.2	P11177	details
Acetyl-CoA acetyltransferase, cytosolic	ACAT2	6q25.3	Q9BWD1	details
Diamine acetyltransferase 2	SAT2	17p13.1	Q96F10	details
Malonyl-CoA decarboxylase, mitochondrial	MLYCD	16q24	O95822	details
Acetyl-CoA carboxylase 2	ACACB	12q24.11	O00763	details
Pyruvate carboxylase, mitochondrial	PC	11q13.4-q13.5	P11498	details
Arylamine N-acetyltransferase 1	NAT1	8p22	P18440	details
Arylamine N-acetyltransferase 2	NAT2	8p22	P11245	details
5-aminolevulinate synthase, nonspecific, mitochondrial	ALAS1	3p21.1	P13196	details
General transcription factor 3C polypeptide 4	GTF3C4	9q34.13	Q9UKN8	details
Acyl-coenzyme A thioesterase 12	ACOT12	5q14.1	Q8WYK0	details
Choline O-acetyltransferase	CHAT	10q11.2	P28329	details
Nuclear receptor coactivator 3	NCOA3	20q12	Q9Y6Q9	details
Histone acetyltransferase KAT2B	KAT2B	3p24	Q92831	details
Carnitine O-acetyltransferase	CRAT	9q34.1	P43155	details
Diamine acetyltransferase 1	SAT1	Xp22.1	P21673	details
Serotonin N-acetyltransferase	AANAT	17q25	Q16613	details
3-ketoacyl-CoA thiolase, mitochondrial	ACAA2	18q21.1	P42765	details
Testis-specific chromodomain protein Y 1	CDY1	Yq11.23	Q9Y6F8	details
Fatty acid synthase	FASN	17q25	P49327	details
Histone acetyltransferase KAT5	KAT5	11q13	Q92993	details
Acetyl-coenzyme A synthetase, cytoplasmic	ACSS2	20q11.22	Q9NR19	details
Acetyl-CoA acetyltransferase, mitochondrial	ACAT1	11q22.3	P24752	details
Nuclear receptor coactivator 1	NCOA1	2p23	Q15788	details
Hydroxymethylglutaryl-CoA synthase, mitochondrial	HMGCS2	1p13-p12	P54868	details
Acetyl-coenzyme A synthetase 2-like, mitochondrial	ACSS1	20p11.23-p11.21	Q9NUB1	details
Citrate synthase, mitochondrial	CS	12q13.2	O75390	details
Testis-specific chromodomain protein Y 2	CDY2A	Yq11.221	Q9Y6F7	details
3-ketoacyl-CoA thiolase, peroxisomal	ACAA1	3p22.2	P09110	details
Pyruvate dehydrogenase E1 component subunit alpha, somatic form, mitochondrial	PDHA1	Xp22.1	P08559	details
Acetyl-CoA carboxylase 1	ACACA	17q21	Q13085	details
Trifunctional enzyme subunit beta, mitochondrial	HADHB	2p23	P55084	details
2-amino-3-ketobutyrate coenzyme A ligase, mitochondrial	GCAT	22q13.1	O75600	details
Pyruvate dehydrogenase E1 component subunit alpha, testis-specific form, mitochondrial	PDHA2	4q22-q23	P29803	details
Methylmalonate-semialdehyde dehydrogenase [acylating], mitochondrial	ALDH6A1	14q24.3	Q02252	details
Glucosamine 6-phosphate N-acetyltransferase	GNPNAT1	14q22.1	Q96EK6	details
Hydroxymethylglutaryl-CoA synthase, cytoplasmic	HMGCS1	5p14-p13	Q01581	details
Dihydrolipoyl dehydrogenase, mitochondrial	DLD	7q31-q32	P09622	details
Dihydrolipoyllysine-residue acetyltransferase component of pyruvate dehydrogenase complex, mitochondrial	DLAT	11q23.1	P10515	details
Long-chain specific acyl-CoA dehydrogenase, mitochondrial	ACADL	2q34	P28330	details
Short-chain specific acyl-CoA dehydrogenase, mitochondrial	ACADS	12q24.31	P16219	details
Medium-chain specific acyl-CoA dehydrogenase, mitochondrial	ACADM	1p31	P11310	details
Peroxisomal acyl-coenzyme A oxidase 1	ACOX1	17q25.1	Q15067	details
Peroxisomal acyl-coenzyme A oxidase 2	ACOX2	3p14.3	Q99424	details
Isovaleryl-CoA dehydrogenase, mitochondrial	IVD	15q14-q15	P26440	details
Peroxisomal acyl-coenzyme A oxidase 3	ACOX3	4p15.3	O15254	details
Glutaryl-CoA dehydrogenase, mitochondrial	GCDH	19p13.2	Q92947	details
Hepatic triacylglycerol lipase	LIPC	15q21-q23	P11150	details
Diacylglycerol O-acyltransferase 1	DGAT1	8q24.3	O75907	details
2-oxoisovalerate dehydrogenase subunit beta, mitochondrial	BCKDHB	6q14.1	P21953	details
2-oxoisovalerate dehydrogenase subunit alpha, mitochondrial	BCKDHA	19q13.1-q13.2	P12694	details
Acyl-CoA desaturase	SCD	10q24.31	O00767	details
Sterol O-acyltransferase 2	SOAT2	12q13.13	O75908	details
Sterol O-acyltransferase 1	SOAT1	1q25	P35610	details
N-acetylglutamate synthase, mitochondrial	NAGS	17q21.31	Q8N159	details
Bile acid-CoA:amino acid N-acyltransferase	BAAT	9q22.3	Q14032	details
Long-chain-fatty-acid--CoA ligase 4	ACSL4	Xq22.3-q23	O60488	details
Long-chain-fatty-acid--CoA ligase 1	ACSL1	4q35	P33121	details
Long-chain-fatty-acid--CoA ligase 6	ACSL6	5q31	Q9UKU0	details
Long-chain-fatty-acid--CoA ligase 5	ACSL5	10q25.1-q25.2	Q9ULC5	details
Long-chain-fatty-acid--CoA ligase 3	ACSL3	2q34-q35	O95573	details
Glycerol-3-phosphate acyltransferase 1, mitochondrial	GPAM	10q25.2	Q9HCL2	details
Trans-2-enoyl-CoA reductase, mitochondrial	MECR	1p35.3	Q9BV79	details
Peroxisomal trans-2-enoyl-CoA reductase	PECR	2q35	Q9BY49	details
Cytosolic acyl coenzyme A thioester hydrolase	ACOT7	1p36	O00154	details
Acyl-coenzyme A thioesterase 2, mitochondrial	ACOT2	14q24.3	P49753	details
Acyl-coenzyme A thioesterase 4	ACOT4	14q24.3	Q8N9L9	details
Acyl-coenzyme A thioesterase 8	ACOT8	20q13.12	O14734	details
Dihydroxyacetone phosphate acyltransferase	GNPAT	1q42	O15228	details
1-acyl-sn-glycerol-3-phosphate acyltransferase gamma	AGPAT3	21q22.3	Q9NRZ7	details
1-acyl-sn-glycerol-3-phosphate acyltransferase beta	AGPAT2	9q34.3	O15120	details
1-acyl-sn-glycerol-3-phosphate acyltransferase alpha	AGPAT1	6p21.3	Q99943	details
Short/branched chain specific acyl-CoA dehydrogenase, mitochondrial	ACADSB	10q26.13	P45954	details
Very long-chain acyl-CoA synthetase	SLC27A2	15q21.2	O14975	details
Peroxisome proliferator-activated receptor gamma	PPARG	3p25	P37231	details
Peroxisome proliferator-activated receptor alpha	PPARA	22q12-q13.1\|22q13.31	Q07869	details
Peroxisome proliferator-activated receptor delta	PPARD	6p21.2	Q03181	details
Acyl-CoA-binding protein	DBI	2q12-q21	P07108	details
Histone acetyltransferase KAT2A	KAT2A	17q21	Q92830	details
Fatty acid-binding protein, heart	FABP3	1p33-p32	P05413	details
1-acyl-sn-glycerol-3-phosphate acyltransferase epsilon	AGPAT5	8p23.1	Q9NUQ2	details
Acetyl-coenzyme A transporter 1	SLC33A1	3q25.31	O00400	details
Bile acyl-CoA synthetase	SLC27A5	19q13.43	Q9Y2P5	details
Lipoamide acyltransferase component of branched-chain alpha-keto acid dehydrogenase complex, mitochondrial	DBT	1p31	P11182	details
2-acylglycerol O-acyltransferase 2	MOGAT2	11q13.5	Q3SYC2	details
Long-chain fatty acid transport protein 3	SLC27A3	1q21.3	Q5K4L6	details
Acyl-CoA dehydrogenase family member 10	ACAD10	12q24.12	Q6JQN1	details
Acyl-CoA dehydrogenase family member 11	ACAD11	3q22.1	Q709F0	details
Glycerol-3-phosphate acyltransferase 4	AGPAT6	8p11.21	Q86UL3	details
Acyl-coenzyme A synthetase ACSM1, mitochondrial	ACSM1	16p12.3	Q08AH1	details
Diacylglycerol O-acyltransferase 2	DGAT2	11q13.5	Q96PD7	details
1-acyl-sn-glycerol-3-phosphate acyltransferase delta	AGPAT4	6q26	Q9NRZ5	details
2-acylglycerol O-acyltransferase 1	MOGAT1	2q36.1	Q96PD6	details
3-hydroxymethyl-3-methylglutaryl-CoA lyase, cytoplasmic	HMGCLL1	6p12.1	Q8TB92	details
Isobutyryl-CoA dehydrogenase, mitochondrial	ACAD8	11q25	Q9UKU7	details
Acyl-CoA dehydrogenase family member 9, mitochondrial	ACAD9	3q21.3	Q9H845	details
Long-chain fatty acid transport protein 4	SLC27A4	9q34.11	Q6P1M0	details
Fatty acyl-CoA reductase 1	FAR1	11p15.2	Q8WVX9	details
Fatty acyl-CoA reductase 2	FAR2	12p11.22	Q96K12	details
Acyl-CoA wax alcohol acyltransferase 1	AWAT1	Xq13.1	Q58HT5	details
Acyl-CoA wax alcohol acyltransferase 2	AWAT2	Xq13.1	Q6E213	details
Diacylglycerol O-acyltransferase 2-like protein 6	DGAT2L6		Q6ZPD8	details
Putative diacylglycerol O-acyltransferase 2-like protein 7	DGAT2L7	7q22.1	Q6IED9	details
2-acylglycerol O-acyltransferase 3	MOGAT3	7q22.1	Q86VF5	details
Lysophospholipid acyltransferase 5	LPCAT3	12p13	Q6P1A2	details
Lysophosphatidylcholine acyltransferase 1	LPCAT1	5p15.33	Q8NF37	details
Lysophosphatidylcholine acyltransferase 2	LPCAT2	16q12.2	Q7L5N7	details
Lysocardiolipin acyltransferase 1	LCLAT1	2p23.1	Q6UWP7	details
Lysophospholipid acyltransferase LPCAT4	LPCAT4	15q14	Q643R3	details
Glycerol-3-phosphate acyltransferase 3	AGPAT9	4q21.23	Q53EU6	details
Glycine N-acyltransferase	GLYAT	11q12.1	Q6IB77	details
Glycine N-acyltransferase-like protein 1	GLYATL1	11q12.1	Q969I3	details
Glycine N-acyltransferase-like protein 2	GLYATL2	11q12.1	Q8WU03	details
Dihydrolipoamide S-acetyltransferase	DLAT	11q23.1	Q86YI5	details
Enoyl-CoA delta isomerase 2, mitochondrial	ECI2	6p24.3	O75521	details
Acyl-CoA synthetase family member 4	AASDH	4q12	Q4L235	details
ACSS2 protein	ACSS2	20q11.22	Q96FY7	details
Very long-chain specific acyl-CoA dehydrogenase, mitochondrial	ACADVL	17p13.1	P49748	details
Acyl-coenzyme A oxidase-like protein	ACOXL	2q13	Q9NUZ1	details
Acyl-coenzyme A synthetase ACSM6, mitochondrial	ACSM6	10q23.33	Q6P461	details
Acyl-coenzyme A synthetase ACSM2A, mitochondrial	ACSM2A	16p12.3	Q08AH3	details
Acyl-coenzyme A synthetase ACSM2B, mitochondrial	ACSM2B	16p12.3	Q68CK6	details
Acyl-coenzyme A synthetase ACSM3, mitochondrial	ACSM3	16p13.11	Q53FZ2	details
Acyl-coenzyme A synthetase ACSM5, mitochondrial	ACSM5	16p12.3	Q6NUN0	details
Peroxisomal coenzyme A diphosphatase NUDT7	NUDT7	16q23.1	P0C024	details
Acyl-coenzyme A synthetase ACSM4, mitochondrial	ACSM4	12p13.31	P0C7M7	details
3-oxoacyl-[acyl-carrier-protein] synthase, mitochondrial	OXSM	3p24.2	Q9NWU1	details
Histone acetyltransferase KAT6B	KAT6B	10q22.2	Q8WYB5	details
MYST3 protein	MYST3	8p11	A5PKX7	details
Histone acetyltransferase KAT8	KAT8	16p11.2	Q9H7Z6	details
Histone acetyltransferase type B catalytic subunit	HAT1	2q31.2-q33.1	O14929	details
Glycerol-3-phosphate acyltransferase 2, mitochondrial	GPAT2	2q11.1	Q6NUI2	details
Chromodomain Y-like protein	CDYL	6p25.1	Q9Y232	details
Peroxisomal D3,D2-enoyl-CoA isomerase isoform 1 variant			Q53GC8	details
Nef-associated protein 1	C9orf156	9q22.33	Q9BU70	details
Acyl-coenzyme A thioesterase 9, mitochondrial	ACOT9		Q9Y305	details
Acyl-CoA synthetase family member 3, mitochondrial	ACSF3	16q24.3	Q4G176	details
Acyl-coenzyme A thioesterase 1	ACOT1	14q24.3	Q86TX2	details
Cytosolic acyl coenzyme A thioester hydrolase-like	ACOT7L		Q6ZUV0	details
Acyl-CoA synthetase family member 2, mitochondrial	ACSF2	17q21.33	Q96CM8	details
Acyl-coenzyme A thioesterase 11	ACOT11	1p32.3	Q8WXI4	details
Long-chain-fatty-acid--CoA ligase ACSBG2	ACSBG2	19p13.3	Q5FVE4	details
Long-chain-fatty-acid--CoA ligase ACSBG1	ACSBG1	15q23-q24	Q96GR2	details
Circadian locomoter output cycles protein kaput	CLOCK	4q12	O15516	details
Histone acetyltransferase KAT7	KAT7	17q21.32	O95251	details
Acyl-CoA synthetase short-chain family member 3, mitochondrial	ACSS3	12q21.31	Q9H6R3	details
Alpha-tubulin N-acetyltransferase	ATAT1	6p21.33	Q5SQI0	details
Heparan-alpha-glucosaminide N-acetyltransferase	HGSNAT	8p11.1	Q68CP4	details
Histone acetyltransferase KAT6A	KAT6A	8p11	Q92794	details
N-alpha-acetyltransferase 10	NAA10	Xq28	P41227	details
N-alpha-acetyltransferase 11	NAA11	4q21.21	Q9BSU3	details
N-alpha-acetyltransferase 20	NAA20	20p11.23	P61599	details
N-alpha-acetyltransferase 30	NAA30	14q22.3	Q147X3	details
N-alpha-acetyltransferase 60	NAA60	16p13.3	Q9H7X0	details
N-acetylaspartate synthetase	NAT8L	4p16.3	Q8N9F0	details

Transporters

Protein Name	Gene Name	Locus	Uniprot ID	Details
Fatty acid synthase	FASN	17q25	P49327	details
Very long-chain acyl-CoA synthetase	SLC27A2	15q21.2	O14975	details
Fatty acid-binding protein, heart	FABP3	1p33-p32	P05413	details
Acetyl-coenzyme A transporter 1	SLC33A1	3q25.31	O00400	details
Bile acyl-CoA synthetase	SLC27A5	19q13.43	Q9Y2P5	details
Long-chain fatty acid transport protein 1	SLC27A1	19p13.11	Q6PCB7	details
Acyl-CoA synthetase family member 4	AASDH	4q12	Q4L235	details
Fatty acid-binding protein, intestinal	FABP2	4q28-q31	P12104	details

Metal Bindings

Protein Name	Gene Name	Locus	Uniprot ID	Details
ATP-citrate synthase	ACLY	17q21.2	P53396	details
Histone acetyltransferase p300	EP300	22q13.2	Q09472	details
CREB-binding protein	CREBBP	16p13.3	Q92793	details
Acetyl-CoA carboxylase 2	ACACB	12q24.11	O00763	details
Pyruvate carboxylase, mitochondrial	PC	11q13.4-q13.5	P11498	details
Fatty acid synthase	FASN	17q25	P49327	details
Histone acetyltransferase KAT5	KAT5	11q13	Q92993	details
Acetyl-CoA acetyltransferase, mitochondrial	ACAT1	11q22.3	P24752	details
Acetyl-CoA carboxylase 1	ACACA	17q21	Q13085	details
2-oxoisovalerate dehydrogenase subunit alpha, mitochondrial	BCKDHA	19q13.1-q13.2	P12694	details
Acyl-CoA desaturase	SCD	10q24.31	O00767	details
Trans-2-enoyl-CoA reductase, mitochondrial	MECR	1p35.3	Q9BV79	details
Peroxisome proliferator-activated receptor gamma	PPARG	3p25	P37231	details
Peroxisome proliferator-activated receptor alpha	PPARA	22q12-q13.1\|22q13.31	Q07869	details
Peroxisome proliferator-activated receptor delta	PPARD	6p21.2	Q03181	details
Acyl-coenzyme A synthetase ACSM1, mitochondrial	ACSM1	16p12.3	Q08AH1	details
3-hydroxymethyl-3-methylglutaryl-CoA lyase, cytoplasmic	HMGCLL1	6p12.1	Q8TB92	details
Lysophosphatidylcholine acyltransferase 1	LPCAT1	5p15.33	Q8NF37	details
Lysophosphatidylcholine acyltransferase 2	LPCAT2	16q12.2	Q7L5N7	details
Acyl-coenzyme A synthetase ACSM6, mitochondrial	ACSM6	10q23.33	Q6P461	details
Acyl-coenzyme A synthetase ACSM2A, mitochondrial	ACSM2A	16p12.3	Q08AH3	details
Acyl-coenzyme A synthetase ACSM2B, mitochondrial	ACSM2B	16p12.3	Q68CK6	details
Acyl-coenzyme A synthetase ACSM3, mitochondrial	ACSM3	16p13.11	Q53FZ2	details
Acyl-coenzyme A synthetase ACSM5, mitochondrial	ACSM5	16p12.3	Q6NUN0	details
Peroxisomal coenzyme A diphosphatase NUDT7	NUDT7	16q23.1	P0C024	details
Elongator complex protein 3	ELP3	8p21.1	Q9H9T3	details
Acyl-coenzyme A synthetase ACSM4, mitochondrial	ACSM4	12p13.31	P0C7M7	details
Histone acetyltransferase KAT6B	KAT6B	10q22.2	Q8WYB5	details
MYST3 protein	MYST3	8p11	A5PKX7	details
Histone acetyltransferase KAT8	KAT8	16p11.2	Q9H7Z6	details
Histone acetyltransferase KAT7	KAT7	17q21.32	O95251	details
Histone acetyltransferase KAT6A	KAT6A	8p11	Q92794	details

Receptors

Protein Name	Gene Name	Locus	Uniprot ID	Details
Histone acetyltransferase p300	EP300	22q13.2	Q09472	details
Nuclear receptor coactivator 3	NCOA3	20q12	Q9Y6Q9	details
Histone acetyltransferase KAT5	KAT5	11q13	Q92993	details
Nuclear receptor coactivator 1	NCOA1	2p23	Q15788	details
Peroxisome proliferator-activated receptor gamma	PPARG	3p25	P37231	details
Peroxisome proliferator-activated receptor alpha	PPARA	22q12-q13.1\|22q13.31	Q07869	details
Peroxisome proliferator-activated receptor delta	PPARD	6p21.2	Q03181	details
Benzodiazepine receptor ligand	BRL		Q71U42	details

Transcriptional Factors

Protein Name	Gene Name	Locus	Uniprot ID	Details
Histone acetyltransferase p300	EP300	22q13.2	Q09472	details
CREB-binding protein	CREBBP	16p13.3	Q92793	details
General transcription factor 3C polypeptide 4	GTF3C4	9q34.13	Q9UKN8	details
Nuclear receptor coactivator 3	NCOA3	20q12	Q9Y6Q9	details
Histone acetyltransferase KAT2B	KAT2B	3p24	Q92831	details
Histone acetyltransferase KAT5	KAT5	11q13	Q92993	details
Nuclear receptor coactivator 1	NCOA1	2p23	Q15788	details
Peroxisome proliferator-activated receptor gamma	PPARG	3p25	P37231	details
Peroxisome proliferator-activated receptor alpha	PPARA	22q12-q13.1\|22q13.31	Q07869	details
Peroxisome proliferator-activated receptor delta	PPARD	6p21.2	Q03181	details
Histone acetyltransferase KAT2A	KAT2A	17q21	Q92830	details
Isobutyryl-CoA dehydrogenase, mitochondrial	ACAD8	11q25	Q9UKU7	details
Elongator complex protein 3	ELP3	8p21.1	Q9H9T3	details
Histone acetyltransferase KAT6B	KAT6B	10q22.2	Q8WYB5	details
MYST3 protein	MYST3	8p11	A5PKX7	details
Histone acetyltransferase KAT8	KAT8	16p11.2	Q9H7Z6	details
Chromodomain Y-like protein	CDYL	6p25.1	Q9Y232	details
Circadian locomoter output cycles protein kaput	CLOCK	4q12	O15516	details
Histone acetyltransferase KAT7	KAT7	17q21.32	O95251	details
Histone acetyltransferase KAT6A	KAT6A	8p11	Q92794	details

Concentrations Data

Not Available

External Links

HMDB ID

HMDB0001206

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Wikipedia Link

METLIN ID

PubChem Compound

PDB ID

Not Available

ChEBI ID

15351

References

General References

Not Available

Only showing the first 10 proteins. There are 226 proteins in total.

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Enzymes

Enzyme Details

1. Hydroxymethylglutaryl-CoA lyase, mitochondrial

General function:: Involved in catalytic activity
Specific function:: Key enzyme in ketogenesis (ketone body formation). Terminal step in leucine catabolism.
Gene Name:: HMGCL
Uniprot ID:: P35914
Molecular weight:: 34359.84

Enzyme Details

2. ATP-citrate synthase

General function:: Involved in ATP citrate synthase activity
Specific function:: ATP citrate-lyase is the primary enzyme responsible for the synthesis of cytosolic acetyl-CoA in many tissues. Has a central role in de novo lipid synthesis. In nervous tissue it may be involved in the biosynthesis of acetylcholine.
Gene Name:: ACLY
Uniprot ID:: P53396
Molecular weight:: 120838.27

Enzyme Details

3. Histone acetyltransferase p300

General function:: Involved in transcription cofactor activity
Specific function:: Functions as histone acetyltransferase and regulates transcription via chromatin remodeling. Acetylates all four core histones in nucleosomes. Histone acetylation gives an epigenetic tag for transcriptional activation. Mediates cAMP-gene regulation by binding specifically to phosphorylated CREB protein. Also functions as acetyltransferase for nonhistone targets. Acetylates 'Lys-131' of ALX1 and acts as its coactivator in the presence of CREBBP. Acetylates SIRT2 and is proposed to indirectly increase the transcriptional activity of TP53 through acetylation and subsequent attenuation of SIRT2 deacetylase function. Acetylates HDAC1 leading to its inactivation and modulation of transcription. Acts as a TFAP2A-mediated transcriptional coactivator in presence of CITED2. Plays a role as a coactivator of NEUROD1-dependent transcription of the secretin and p21 genes and controls terminal differentiation of cells in the intestinal epithelium. Promotes cardiac myocyte enlargement. Can also mediate transcriptional repression. Binds to and may be involved in the transforming capacity of the adenovirus E1A protein. In case of HIV-1 infection, it is recruited by the viral protein Tat. Regulates Tat's transactivating activity and may help inducing chromatin remodeling of proviral genes. Acetylates FOXO1 and enhances its transcriptional activity.
Gene Name:: EP300
Uniprot ID:: Q09472
Molecular weight:: 264159.725

Enzyme Details

4. Pyruvate dehydrogenase E1 component subunit beta, mitochondrial

General function:: Involved in catalytic activity
Specific function:: The pyruvate dehydrogenase complex catalyzes the overall conversion of pyruvate to acetyl-CoA and CO(2), and thereby links the glycolytic pathway to the tricarboxylic cycle.
Gene Name:: PDHB
Uniprot ID:: P11177
Molecular weight:: 39233.1

Enzyme Details

5. Acetyl-CoA acetyltransferase, cytosolic

General function:: Involved in transferase activity, transferring acyl groups other than amino-acyl groups
Specific function:: Not Available
Gene Name:: ACAT2
Uniprot ID:: Q9BWD1
Molecular weight:: 41350.5

Enzyme Details

6. Diamine acetyltransferase 2

General function:: Involved in N-acetyltransferase activity
Specific function:: Enzyme which catalyzes the acetylation of polyamines. Substrate specificity: norspermidine > spermidine = spermine >> N(1)acetylspermine = putrescine.
Gene Name:: SAT2
Uniprot ID:: Q96F10
Molecular weight:: 19154.905

Enzyme Details

7. Malonyl-CoA decarboxylase, mitochondrial

General function:: Involved in malonyl-CoA decarboxylase activity
Specific function:: Catalyzes the conversion of malonyl-CoA to acetyl-CoA. In the fatty acid biosynthesis MCD selectively removes malonyl-CoA and thus assures that methyl-malonyl-CoA is the only chain elongating substrate for fatty acid synthase and that fatty acids with multiple methyl side chains are produced. In peroxisomes it may be involved in degrading intraperoxisomal malonyl-CoA, which is generated by the peroxisomal beta-oxidation of odd chain-length dicarboxylic fatty acids.
Gene Name:: MLYCD
Uniprot ID:: O95822
Molecular weight:: 55002.94

Enzyme Details

8. Acetyl-CoA carboxylase 2

General function:: Involved in acetyl-CoA carboxylase activity
Specific function:: ACC-beta may be involved in the provision of malonyl-CoA or in the regulation of fatty acid oxidation, rather than fatty acid biosynthesis. Carries out three functions: biotin carboxyl carrier protein, biotin carboxylase and carboxyltransferase.
Gene Name:: ACACB
Uniprot ID:: O00763
Molecular weight:: 276538.575

Enzyme Details

9. Pyruvate carboxylase, mitochondrial

General function:: Involved in catalytic activity
Specific function:: Pyruvate carboxylase catalyzes a 2-step reaction, involving the ATP-dependent carboxylation of the covalently attached biotin in the first step and the transfer of the carboxyl group to pyruvate in the second. Catalyzes in a tissue specific manner, the initial reactions of glucose (liver, kidney) and lipid (adipose tissue, liver, brain) synthesis from pyruvate.
Gene Name:: PC
Uniprot ID:: P11498
Molecular weight:: 129632.565

Enzyme Details

10. Arylamine N-acetyltransferase 1

General function:: Involved in acetyltransferase activity
Specific function:: Participates in the detoxification of a plethora of hydrazine and arylamine drugs. Catalyzes the N- or O-acetylation of various arylamine and heterocyclic amine substrates and is able to bioactivate several known carcinogens.
Gene Name:: NAT1
Uniprot ID:: P18440
Molecular weight:: 33898.445

Transporters

Enzyme Details

1. Fatty acid synthase

General function:: Involved in transferase activity
Specific function:: Fatty acid synthetase catalyzes the formation of long-chain fatty acids from acetyl-CoA, malonyl-CoA and NADPH. This multifunctional protein has 7 catalytic activities and an acyl carrier protein.
Gene Name:: FASN
Uniprot ID:: P49327
Molecular weight:: 273424.06

Enzyme Details

2. Very long-chain acyl-CoA synthetase

General function:: Involved in catalytic activity
Specific function:: Acyl-CoA synthetase probably involved in bile acid metabolism. Proposed to activate C27 precurors of bile acids to their CoA thioesters derivatives before side chain cleavage via peroxisomal beta-oxidation occurs. In vitro, activates 3-alpha,7-alpha,12-alpha-trihydroxy-5-beta-cholestanate (THCA), the C27 precursor of cholic acid deriving from the de novo synthesis from cholesterol. Does not utilize C24 bile acids as substrates. In vitro, also activates long- and branched-chain fatty acids and may have additional roles in fatty acid metabolism. May be involved in translocation of long-chain fatty acids (LFCA) across membranes (By similarity).
Gene Name:: SLC27A2
Uniprot ID:: O14975
Molecular weight:: 64614.99

Enzyme Details

3. Fatty acid-binding protein, heart

General function:: Involved in negative regulation of cell proliferation
Specific function:: FABP are thought to play a role in the intracellular transport of long-chain fatty acids and their acyl-CoA esters
Gene Name:: FABP3
Uniprot ID:: P05413
Molecular weight:: 14857.9

Enzyme Details

4. Acetyl-coenzyme A transporter 1

General function:: Carbohydrate transport and metabolism
Specific function:: Probable acetyl-CoA transporter necessary for O-acetylation of gangliosides.
Gene Name:: SLC33A1
Uniprot ID:: O00400
Molecular weight:: 60908.39

Enzyme Details

5. Bile acyl-CoA synthetase

General function:: Involved in catalytic activity
Specific function:: Acyl-CoA synthetase involved in bile acid metabolism. Proposed to catalyze the first step in the conjugation of C24 bile acids (choloneates) to glycine and taurine before excretion into bile canaliculi by activating them to their CoA thioesters. Seems to activate secondary bile acids entering the liver from the enterohepatic circulation. In vitro, also activates 3-alpha,7-alpha,12-alpha-trihydroxy-5-beta-cholestanate (THCA), the C27 precursor of cholic acid deriving from the de novo synthesis from cholesterol.
Gene Name:: SLC27A5
Uniprot ID:: Q9Y2P5
Molecular weight:: 75384.375

Enzyme Details

6. Long-chain fatty acid transport protein 1

General function:: Lipid transport and metabolism
Specific function:: Involved in translocation of long-chain fatty acids (LFCA) across the plasma membrane. The LFCA import appears to be hormone-regulated in a tissue-specific manner. In adipocytes, but not myocytes, insulin induces a rapid translocation of FATP1 from intracellular compartments to the plasma membrane, paralleled by increased LFCA uptake. May act directly as a bona fide transporter, or alternatively, in a cytoplasmic or membrane- associated multimeric protein complex to trap and draw fatty acids towards accumulation. Plays a pivotal role in regulating available LFCA substrates from exogenous sources in tissues undergoing high levels of beta-oxidation or triglyceride synthesis. May be involved in regulation of cholesterol metabolism. Has acyl-CoA ligase activity for long-chain and very-long-chain fatty acids
Gene Name:: SLC27A1
Uniprot ID:: Q6PCB7
Molecular weight:: 71107.5

Enzyme Details

7. Acyl-CoA synthetase family member 4

General function:: Involved in acyl carrier activity
Specific function:: Acyl-CoA synthases catalyze the initial reaction in fatty acid metabolism, by forming a thioester with CoA
Gene Name:: AASDH
Uniprot ID:: Q4L235
Molecular weight:: 122596.1

Enzyme Details

8. Fatty acid-binding protein, intestinal

General function:: Involved in binding
Specific function:: FABP are thought to play a role in the intracellular transport of long-chain fatty acids and their acyl-CoA esters. FABP2 is probably involved in triglyceride-rich lipoprotein synthesis. Binds saturated long-chain fatty acids with a high affinity, but binds with a lower affinity to unsaturated long- chain fatty acids. FABP2 may also help maintain energy homeostasis by functioning as a lipid sensor
Gene Name:: FABP2
Uniprot ID:: P12104
Molecular weight:: 15207.2

Only showing the first 10 proteins. There are 226 proteins in total.

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Showing Compound Card for Acetyl-CoA (CDB005092)

Structure for CDB005092 (Acetyl-CoA)

Enzymes

Transporters