β-cembratriene-4,6-diol

Chemical Formula:

C₂₀H₃₄O₂

Molecular Weight:

306.487 Daltons

Monoisotopic Mass:

306.2558803356 Daltons

SMILES:

CC(C1(C=CC(C)(O)CC(O)C=C(C)CCC=C(C)CC1))C

InChI:

1S/C20H34O2/c1-15(2)18-10-9-16(3)7-6-8-17(4)13-19(21)14-20(5,22)12-11-18/h7,11-13,15,18-19,21-22H,6,8-10,14H2,1-5H3/b12-11+,16-7+,17-13+/t18-,19+,20?/m1/s1

InChIKey:

RIVKDDXPCFBMOV-QRHQPKQBSA-N

Synonyms

2,7,11-cembratriene-4,6-diol, β-isomer

Databases

MetaCyc: CPD-18856

PubChem (CID): 122706036

ChemSpider: 20143685

ChEBI: 959

MetaNetX: MNXM491843