Molecule ID: 46187190

IUPAC Name: (1R,4S,5R,6R,7S,10S)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]decan-4-ol

Description: The molecule is a sesquiterpenoid consisting of octahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzen-3-ol carrying two additional methyl substituents at positions 3 and 7 as well as an isopropyl substituent at position 4 (the 3S,3aR,3bR,4S,7S,7aR diastereomer). It is a carbotricyclic compound, a sesquiterpenoid and a tertiary alcohol.

SMILES: CC(C)[C@@H]1CC[C@H](C)[C@@]23CC[C@](C)(O)[C@@H]2[C@@H]13

SELFIES: [C][C][Branch1][C][C][C@@H1][C][C][C@H1][Branch1][C][C][C@@][C][C][C@][Branch1][C][C][Branch1][C][O][C@@H1][Ring1][#Branch1][C@@H1][Ring1][=N][Ring1][Branch2]

InChI: InChI=1S/C15H26O/c1-9(2)11-6-5-10(3)15-8-7-14(4,16)13(15)12(11)15/h9-13,16H,5-8H2,1-4H3/t10-,11-,12+,13-,14-,15+/m0/s1

Molecular Properties:
- Polar Surface Area: 20.2 Ų
- LogP: 3.9