campest-4-en-3-one

Chemical Formula:

C₂₈H₄₆O

Molecular Weight:

398.671 Daltons

Monoisotopic Mass:

398.3548660987 Daltons

SMILES:

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

InChI:

1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h17-20,23-26H,7-16H2,1-6H3/t19-,20-,23+,24-,25+,26+,27+,28-/m1/s1

InChIKey:

QQIOPZFVTIHASB-IMUDCKKOSA-N

Synonyms

methylcholestenone
(24R)-24-methyl-cholest-4-en-3-one
3-dehydro-Δ^4-5-campesterol

Databases

MetaCyc: CPD-698

ChEBI: 18534

PubChem (CID): 11988279

HMDB: HMDB12196

KEGG: C15785

RefMet: Campest-4-en-3-one

Seed: cpd14521

MetaNetX: MNXM3936