C33-phthiotriol A

Chemical Formula:

C₃₃H₆₈O₃

Molecular Weight:

512.898 Daltons

Monoisotopic Mass:

512.5168460491001 Daltons

SMILES:

CCCCCCCCCCCCCCCCCCCCCC(O)CC(O)CCCCC(C)C(O)CC

InChI:

1S/C33H68O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-31(34)29-32(35)28-25-24-26-30(3)33(36)5-2/h30-36H,4-29H2,1-3H3/t30-,31+,32+,33+/m0/s1

InChIKey:

LCBMZQAFNALYOG-LDLFXXLYSA-N

Synonyms

4-methyldotriacontane-3,9,11-triol

Databases

MetaCyc: CPD-18630

PubChem (CID): 122706129

MetaNetX: MNXM164635