coprostanone
Chemical Formula:
C27H46O
Molecular Weight:
386.66 Daltons
Monoisotopic Mass:
386.3548660987 Daltons
SMILES:
CC(C)CCCC(C)[CH]3(CC[CH]4([CH]2(CC[CH]1(CC(=O)CCC(C)1[CH]2CCC(C)34))))
InChI:
1S/C27H46O/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/h18-20,22-25H,6-17H2,1-5H3/t19-,20+,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey:
Synonyms
- 5α-cholestan-3-one
Databases
MetaCyc:
CPD-1081
HMDB:
HMDB00871
ChemSpider:
83174
PubChem (CID):
92128
ChEBI:
17762
KEGG:
C03238
CAS:
566-88-1
Seed:
cpd02073
MetaNetX:
MNXM4404