cholesterol
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=C1(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/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey:
Synonyms
- 5-cholestene-3β-ol
Databases
MetaCyc:
CHOLESTEROL
RefMet:
Cholesterol
MetaboLights:
MTBLC16113
HMDB:
HMDB00067
DRUGBANK:
DB04540
ChemSpider:
5775
PubChem (CID):
5997
ChEBI:
16113
KEGG:
C00187
CAS:
57-88-5
PupChem (SID):
3487
CHEMBL:
CHEMBL112570
CHEMBL1867358
LIPID MAPS:
LMST01010001
LMST01010081
PDB-CCD:
CLR
3DMET:
B01181
NIKKAJI:
J2.804E
MediaDB:
compounds/183/
Seed:
cpd00160
MetaNetX:
MNXM103
KNApSAcK:
C00003648