Molecule ID: 16211587

IUPAC Name: (1R,4S,6S)-4,7,7-trimethylbicyclo[4.1.0]hept-2-ene

Description: The molecule is a monoterpene that is bicyclo[4.1.0]hept-2-ene substituted by methyl groups at positions 4, 7 and 7 respectively (the 1R,4S,6S-stereoisomer). It has a role as a metabolite. It derives from a hydride of a carane.

SMILES: C[C@@H]1C=C[C@@H]2[C@H](C1)C2(C)C

SELFIES: [C][C@@H1][C][=C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][Ring2][Branch1][C][C][C]

InChI: InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4-5,7-9H,6H2,1-3H3/t7-,8-,9+/m1/s1

Molecular Properties:
- Polar Surface Area: 0.0 Ų
- LogP: 3.3