(25S)-26-hydroxycholest-4-en-3-one

Chemical Formula:

C₂₇H₄₄O₂

Molecular Weight:

400.643 Daltons

Monoisotopic Mass:

400.3341306566 Daltons

SMILES:

CC(CO)CCCC(C)[CH]3(CC[CH]4([CH]2(CCC1(=CC(=O)CCC(C)1[CH]2CCC(C)34))))

InChI:

1S/C27H44O2/c1-18(17-28)6-5-7-19(2)23-10-11-24-22-9-8-20-16-21(29)12-14-26(20,3)25(22)13-15-27(23,24)4/h16,18-19,22-25,28H,5-15,17H2,1-4H3/t18-,19+,22-,23+,24-,25-,26-,27+/m0/s1

InChIKey:

CXUORUGFOXGJNY-NYJSJAOLSA-N

Synonyms

(25S)-3-oxocholest-4-en-26-ol

Databases

MetaCyc: CPD-13887

ChEBI: 83860

KEGG: C20143

PubChem (CID): 66932809

MetaNetX: MNXM145957