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CHEBI:16113 - cholesterol

ChEBI IDCHEBI:16113
ChEBI Namecholesterol
Stars
DefinitionA cholestanoid consisting of cholestane having a double bond at the 5,6-position as well as a 3β-hydroxy group.
Secondary ChEBI IDsCHEBI:3659, CHEBI:13982, CHEBI:23204, CHEBI:41564
Last Modified11 February 2022
DownloadsMolfile

FormulaC27H46O
Net Charge0
Average Mass386.664
Monoisotopic Mass386.35487
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CCCC(C)C
InChIInChI=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
InChIKeyHVYWMOMLDIMFJA-DPAQBDIFSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Daphnia galeata (ncbitaxon:27404) - PubMed (12816661)
Mus musculus (ncbitaxon:10090)
- PubMed (4696527)
- PubMed (19425150) Source: BioModels - MODEL1507180067
Chlamydomonas reinhardtii (ncbitaxon:3055) - PubMed (25515814)
Roles Classification

ChEBI Ontology
IUPAC Name 
cholest-5-en-3β-ol
Synonyms  Source
CholesterolKEGG COMPOUND
Cholest-5-en-3beta-olKEGG COMPOUND
CHOLESTEROLPDBeChem
CholesterinNIST Chemistry WebBook
(3β,14β,17α)-cholest-5-en-3-olIUPAC
UniProt Name  Source
cholesterolUniProt
Manual XrefsDatabases
C00187KEGG COMPOUND
LMST01010001LIPID MAPS
CLRPDBeChem
DB04540DrugBank
CholesterolWikipedia
CHOLESTEROLMetaCyc
HMDB0000067HMDB
C00003648KNApSAcK
D00040KEGG DRUG
Registry NumbersSources
Gmelin:550297Gmelin
Reaxys:2060565Reaxys
CAS:57-88-5KEGG COMPOUND
CAS:57-88-5ChemIDplus
CAS:57-88-5NIST Chemistry WebBook
Citations