Molecule ID: 134692035

IUPAC Name: (1R,3R,4R,6R,7S,8S,10Z,12R)-1,4,8-trimethyl-12-propan-2-yltricyclo[9.3.0.03,7]tetradec-10-ene-6,8-diol

Description: The molecule is a carbotricyclic compound that is cyclooctatin in which the hydroxymethyl substituent has been reduced to the corresponding methyl group. It is the biosynthetic precursor of cyclooctatin. It is a diterpenoid, a carbotricyclic compound, a secondary alcohol and a tertiary alcohol. It derives from a cyclooctatin.

SMILES: CC(C)[C@H]1CC[C@]2(C)C[C@H]3[C@@H]([C@H](O)C[C@H]3C)[C@@](C)(O)C/C=C/12

SELFIES: [C][C][Branch1][C][C][C@H1][C][C][C@][Branch1][C][C][C][C@H1][C@@H1][Branch1][#Branch2][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][C@@][Branch1][C][C][Branch1][C][O][C][/C][=C][-/Ring2][Ring1][Ring1][Ring1][S]

InChI: InChI=1S/C20H34O2/c1-12(2)14-6-8-19(4)11-15-13(3)10-17(21)18(15)20(5,22)9-7-16(14)19/h7,12-15,17-18,21-22H,6,8-11H2,1-5H3/b16-7-/t13-,14-,15-,17-,18+,19-,20+/m1/s1

Molecular Properties:
- Polar Surface Area: 40.5 Ų
- LogP: 4.4