cholest-5-en-3-one

Chemical Formula:

C₂₇H₄₄O

Molecular Weight:

384.644 Daltons

Monoisotopic Mass:

384.3392160345 Daltons

SMILES:

CC(C)CCCC(C)[CH]3(CC[CH]4([CH]2(CC=C1(CC(=O)CCC(C)1[CH]2CCC(C)34))))

InChI:

1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,22-25H,6-8,10-17H2,1-5H3/t19-,22+,23-,24+,25+,26+,27-/m1/s1

InChIKey:

GGCLNOIGPMGLDB-GYKMGIIDSA-N

Databases

MetaCyc: CPD-13684

PubChem (CID): 9908107

MetaboLights: MTBLC63906

ChEBI: 63906

RefMet: 3-Ketocholesterol 3-ketocholesterol

Seed: cpd23992

MetaNetX: MNXM2990