Mrv1652307282022232D 33 34 0 0 1 0 999 V2000 -5.3912 6.7963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0614 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6404 4.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0297 0.6886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6616 1.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -1.3864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0556 7.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2352 7.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7502 6.9687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0858 6.2151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3469 1.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5209 4.7630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3469 0.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8558 4.7630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6009 5.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0614 1.5011 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7759 5.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1884 4.2781 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4739 2.2156 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6325 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4739 3.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8864 1.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2909 6.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 0.2636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7594 3.4531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6325 -0.9739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1884 3.4531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8996 8.3898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9298 7.0550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6325 1.5011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 2.0845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9235 3.9035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2708 2.4291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7 1 2 0 0 0 0 8 7 1 0 0 0 0 9 8 2 0 0 0 0 10 9 1 0 0 0 0 13 2 1 0 0 0 0 13 11 2 0 0 0 0 14 3 1 0 0 0 0 15 10 1 0 0 0 0 15 14 2 0 0 0 0 16 11 1 1 0 0 0 17 12 1 0 0 0 0 17 15 1 0 0 0 0 18 12 1 0 0 0 0 18 14 1 0 0 0 0 19 16 1 0 0 0 0 20 13 1 0 0 0 0 19 21 1 6 0 0 0 22 4 1 0 0 0 0 22 5 1 0 0 0 0 22 16 1 0 0 0 0 22 19 1 0 0 0 0 23 17 2 0 0 0 0 24 20 2 0 0 0 0 25 21 2 0 0 0 0 26 6 1 0 0 0 0 26 20 1 0 0 0 0 18 27 1 6 0 0 0 27 21 1 0 0 0 0 28 8 1 0 0 0 0 29 9 1 0 0 0 0 30 11 1 0 0 0 0 16 31 1 6 0 0 0 18 32 1 1 0 0 0 19 33 1 1 0 0 0 M END > CDB006300 > CDB > [H]\C(CC1=C(C)[C@]([H])(CC1=O)OC(=O)[C@]1([H])[C@@]([H])(C(\[H])=C(/C)C(=O)OC)C1(C)C)=C(/[H])C=C > InChI=1S/C22H28O5/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6/h7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8-,13-11+/t16-,18+,19+/m1/s1 > VJFUPGQZSXIULQ-XIGJTORUSA-N > C22H28O5 > 372.461 > 372.193674002 > 3 > 55 > 42.00878869439098 > 1 > 0 > 0 > 1 > (1S)-2-methyl-4-oxo-3-[(2Z)-penta-2,4-dien-1-yl]cyclopent-2-en-1-yl (1R,3R)-3-[(1E)-3-methoxy-2-methyl-3-oxoprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate > 4.25 > 4.1543261393333335 > -4.81 > 0 > 2 > 0 > 18.088143422797106 > -5.899382667890335 > 69.67 > 105.51489999999997 > 9 > 1 > 5.73e-03 g/l > pyrethrin II > 0 > CDB006300 > Pyrethrins II $$$$