EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:37623 - 7α,25-dihydroxycholesterol

ChEBI IDCHEBI:37623
ChEBI Name7α,25-dihydroxycholesterol
Stars
ASCII Name7alpha,25-dihydroxycholesterol
Secondary ChEBI IDCHEBI:58676
Last Modified25 April 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC27H46O3
Net Charge0
Average Mass418.662
Monoisotopic Mass418.34470
SMILES[H][C@]12CC[C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)CCCC(C)(C)O)[C@]1([H])[C@H](O)C=C1C[C@@H](O)CC[C@@]12C
InChIInChI=1S/C27H46O3/c1-17(7-6-12-25(2,3)30)20-8-9-21-24-22(11-14-27(20,21)5)26(4)13-10-19(28)15-18(26)16-23(24)29/h16-17,19-24,28-30H,6-15H2,1-5H3/t17-,19+,20-,21+,22+,23-,24+,26+,27-/m1/s1
InChIKeyBQMSKLCEWBSPPY-IKVTXIKFSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
7α,25-dihydroxycholesterol (CHEBI:37623) has functional parent cholesterol (CHEBI:16113)
7α,25-dihydroxycholesterol (CHEBI:37623) has role human metabolite (CHEBI:77746)
7α,25-dihydroxycholesterol (CHEBI:37623) is a 25-hydroxy steroid (CHEBI:36864)
7α,25-dihydroxycholesterol (CHEBI:37623) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722)
7α,25-dihydroxycholesterol (CHEBI:37623) is a 7α-hydroxy steroid (CHEBI:36843)
7α,25-dihydroxycholesterol (CHEBI:37623) is a oxysterol (CHEBI:53030)
IUPAC Name 
cholest-5-ene-3β,7α,25-triol
Synonyms  Source
Cholest-5-ene-3beta,7alpha,25-triolKEGG COMPOUND
7alpha,25-DihydroxycholesterolKEGG COMPOUND
3beta,7alpha,25-Trihydroxycholest-5-eneKEGG COMPOUND
5-Cholesten-3beta,7alpha,25-triolKEGG COMPOUND
UniProt Name  Source
7α,25-dihydroxycholesterolUniProt
Manual XrefsDatabases
C15520KEGG COMPOUND