(1R,3S,4S,5Z)-5-[(2E)-2-[(7aR)-7a-methyl-1-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-(hydroxymethyl)cyclohexane-1,3-diol

Systemtic Name: (1R,3S,4S,5Z)-5-[(2E)-2-[(7aR)-7a-methyl-1-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-(hydroxymethyl)cyclohexane-1,3-diol Openeye Name: (1R,3S,4S,5Z)-5-[(2E)-2-[(7aR)-1-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-(hydroxymethyl)cyclohexane-1,3-diol CAS Name: (1R,3S,4S,5Z)-5-[(2E)-2-[(7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-(hydroxymethyl)cyclohexane-1,3-diol IUPAC Name: (1R,3S,4S,5Z)-5-[(2E)-2-[(7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-(hydroxymethyl)cyclohexane-1,3-diol Traditional Name: (1R,3S,4S,5Z)-5-[(2E)-2-[(7aR)-1-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylol-cyclohexane-1,3-diol Formula: C27H46O4 MolecularWeight: 434.65174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CC(C3CO)O)O)C

Isomeric SMILES

C[C@H](CCCC(C)(C)O)C1CCC\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H]([C@@H]3CO)O)O)C

InChI

InChI=1S/C27H46O4/c1-18(7-5-13-26(2,3)31)23-11-12-24-19(8-6-14-27(23,24)4)9-10-20-15-21(29)16-25(30)22(20)17-28/h9-10,18,21-25,28-31H,5-8,11-17H2,1-4H3/b19-9+,20-10-/t18-,21-,22-,23?,24?,25+,27-/m1/s1