Molecule ID: 86289955

IUPAC Name: (1S,4E,8E,12E)-2,2,5,9,13-pentamethylcyclopentadeca-4,8,12-trien-1-ol

Description: The molecule is a fifteen-membered macrocyclic diterpenoid consisting of (1S,4E,8E,12E)-cyclopentadeca-4,8,12-trien-1-ol carrying five additional methyl substituents at positions 2, 2, 5, 9 and 13. It is a cycloalkatriene, a macrocycle, a diterpenoid, an olefinic compound and a secondary alcohol.

SMILES: C/C1=C\CC/C(C)=C/CC(C)(C)[C@@H](O)CC/C(C)=C/CC1

SELFIES: [C][/C][=C][\C][C][/C][Branch1][C][C][=C][/C][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][C][O][C][C][/C][Branch1][C][C][=C][/C][C][Ring2][Ring1][Ring2]

InChI: InChI=1S/C20H34O/c1-16-8-6-10-17(2)12-13-19(21)20(4,5)15-14-18(3)11-7-9-16/h9-10,14,19,21H,6-8,11-13,15H2,1-5H3/b16-9+,17-10+,18-14+/t19-/m0/s1

Molecular Properties:
- Polar Surface Area: 20.2 Ų
- LogP: 4.8