5,6-β-epoxy-5-β-cholestan-3-β-ol

Chemical Formula:

C₂₇H₄₆O₂

Molecular Weight:

402.659 Daltons

Monoisotopic Mass:

402.34978072079997 Daltons

SMILES:

CC(C)CCCC(C)[CH]4(CC[CH]5([CH]3(CC1(OC21(CC(O)CCC(C)2[CH]3CCC(C)45)))))

InChI:

1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,22+,23+,24-,25-,26-,27-/m1/s1

InChIKey:

PRYIJAGAEJZDBO-DTLXENBRSA-N

Synonyms

Cholesterol-5β,6β-epoxide
5β-6β-Epoxycholestan-3β-ol

Databases

MetaCyc: CPD-8897

LIPID MAPS: LMST01010010

ChemSpider: 97204

PubChem (CID): 108109

KEGG: C05418

ChEBI: 28164

RefMet: 5beta,6beta-Epoxy-cholesterol 5beta,6beta-epoxy-cholesterol

Seed: cpd03209

MetaNetX: MNXM3504