5-[(1R,4Z,7aR)-4-[2-[(3S,5R)-3,5-bis(oxidanyl)cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-(5-methylthiophen-2-yl)hexan-1-one

Systemtic Name: 5-[(1R,4Z,7aR)-4-[2-[(3S,5R)-3,5-bis(oxidanyl)cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-(5-methylthiophen-2-yl)hexan-1-one Openeye Name: 5-[(1R,4Z,7aR)-4-[2-[(3S,5R)-3,5-dihydroxycyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-(5-methyl-2-thienyl)hexan-1-one CAS Name: 5-[(1R,4Z,7aR)-4-[2-[(3S,5R)-3,5-dihydroxycyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-(5-methyl-2-thiophenyl)-1-hexanone IUPAC Name: 5-[(1R,4Z,7aR)-4-[2-[(3S,5R)-3,5-dihydroxycyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-(5-methylthiophen-2-yl)hexan-1-one Traditional Name: 5-[(1R,4Z,7aR)-4-[2-[(3S,5R)-3,5-dihydroxycyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-(5-methyl-2-thienyl)hexan-1-one Formula: C29H42O3S MolecularWeight: 470.70698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCCC(C)C2CCC3C2(CCCC3=CC=C4CC(CC(C4)O)O)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCCC(C)[C@H]2CCC\3[C@@]2(CCC/C3=C/C=C4C[C@@H](C[C@@H](C4)O)O)C

InChI

InChI=1S/C29H42O3S/c1-19(6-4-8-27(32)28-14-9-20(2)33-28)25-12-13-26-22(7-5-15-29(25,26)3)11-10-21-16-23(30)18-24(31)17-21/h9-11,14,19,23-26,30-31H,4-8,12-13,15-18H2,1-3H3/b21-10?,22-11-/t19?,23-,24+,25-,26?,29-/m1/s1