Mrv1533004181501312D 31 33 0 0 0 0 999 V2000 6.8804 -2.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5949 -3.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5949 -3.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3093 -2.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3093 -1.7662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0238 -3.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7383 -2.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4528 -3.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4528 -3.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1672 -2.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2535 -1.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0604 -1.5992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4729 -2.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2934 -2.3999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7783 -1.7325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5988 -1.8187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9344 -2.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7549 -2.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0904 -3.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9109 -3.4985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6055 -4.0797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7850 -3.9935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4495 -3.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9645 -3.9073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6290 -3.1536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1441 -3.8210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9209 -2.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4665 -3.5456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6742 -3.7140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2326 -4.3213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9859 -5.1085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 17 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 14 25 1 0 0 0 0 25 26 2 0 0 0 0 13 27 1 0 0 0 0 10 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 M END > NP0329919 > NP-MRD > CC(C)C(=C)CCC(C)C1CCC(C2CC=C3CC(O)CCC3(C)C2=O)C1(C)CCO > InChI=1S/C28H46O3/c1-18(2)19(3)7-8-20(4)24-11-12-25(28(24,6)15-16-29)23-10-9-21-17-22(30)13-14-27(21,5)26(23)31/h9,18,20,22-25,29-30H,3,7-8,10-17H2,1-2,4-6H3 > KYURAZBDCWKPSB-UHFFFAOYSA-N > C28H46O3 > 430.673 > 430.344695341 > 3 > 77 > 52.066516839323526 > 1 > 2 > 0 > 0 > 6-hydroxy-2-[2-(2-hydroxyethyl)-2-methyl-3-(6-methyl-5-methylideneheptan-2-yl)cyclopentyl]-8a-methyl-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-one > 5.54 > 5.825542991333332 > -5.02 > 1 > 3 > 0 > 18.270272808087725 > 17.45983545624651 > -1.209388913307278 > 57.53 > 129.44499999999996 > 8 > 0 > 4.11e-03 g/l > 6-hydroxy-2-[2-(2-hydroxyethyl)-2-methyl-3-(6-methyl-5-methylideneheptan-2-yl)cyclopentyl]-8a-methyl-2,3,5,6,7,8-hexahydronaphthalen-1-one > 0 > NP0329919 > 6-hydroxy-2-[2-(2-hydroxyethyl)-2-methyl-3-(6-methyl-5-methylideneheptan-2-yl)cyclopentyl]-8a-methyl-2,3,5,6,7,8-hexahydronaphthalen-1-one $$$$