Molecule ID: 69131857

IUPAC Name: 4,6,6,7,8,8-hexamethyl-4,7-dihydro-3H-cyclopenta[g]isochromen-1-one

Description: The molecule is an organic heterotricyclic compound that is 4,6,7,8-tetrahydrocyclopenta[g]isochromen-1(3H)-one substituted by methyl groups at positions 4, 6, 6, 7, 8 and 8 respectively. It is a metabolite of the synthetic musk galaxolide. It has a role as a marine xenobiotic metabolite. It is a member of isochromenes, an organic heterotricyclic compound and a delta-lactone.

SMILES: CC1COC(=O)c2cc3c(cc21)C(C)(C)C(C)C3(C)C

SELFIES: [C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][Ring1][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][C][Ring1][#Branch2][Branch1][C][C][C]

InChI: InChI=1S/C18H24O2/c1-10-9-20-16(19)13-8-15-14(7-12(10)13)17(3,4)11(2)18(15,5)6/h7-8,10-11H,9H2,1-6H3

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 5.0