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CHEBI:86113 - (25R)-4β,26-dihydroxycholesterol

ChEBI IDCHEBI:86113
ChEBI Name(25R)-4β,26-dihydroxycholesterol
Stars
ASCII Name(25R)-4beta,26-dihydroxycholesterol
DefinitionAn oxysterol that is cholesterol which is substituted by hydroxy groups at 4β and 26 positions and has R-configuration at position 25.
Last Modified25 April 2017
Submitternhn
DownloadsMolfile
FormulaC27H46O3
Net Charge0
Average Mass418.662
Monoisotopic Mass418.34470
SMILES[H][C@@]12CC=C3[C@@H](O)[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CCC[C@@H](C)CO
InChIInChI=1S/C27H46O3/c1-17(16-28)6-5-7-18(2)20-10-11-21-19-8-9-23-25(30)24(29)13-15-27(23,4)22(19)12-14-26(20,21)3/h9,17-22,24-25,28-30H,5-8,10-16H2,1-4H3/t17-,18-,19+,20-,21+,22+,24+,25-,26-,27-/m1/s1
InChIKeyIDLRVFXWSUWMHI-KUYJPBLDSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (12077124)
Roles Classification
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
(25R)-4β,26-dihydroxycholesterol (CHEBI:86113) has role human xenobiotic metabolite (CHEBI:76967)
(25R)-4β,26-dihydroxycholesterol (CHEBI:86113) is a 26-hydroxy steroid (CHEBI:36852)
(25R)-4β,26-dihydroxycholesterol (CHEBI:86113) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722)
(25R)-4β,26-dihydroxycholesterol (CHEBI:86113) is a 3β-sterol (CHEBI:35348)
(25R)-4β,26-dihydroxycholesterol (CHEBI:86113) is a 4-hydroxy steroid (CHEBI:62846)
(25R)-4β,26-dihydroxycholesterol (CHEBI:86113) is a cholestanoid (CHEBI:50401)
(25R)-4β,26-dihydroxycholesterol (CHEBI:86113) is a oxysterol (CHEBI:53030)
IUPAC Name 
(25R)-cholest-5-ene-3β,4β,26-triol
Synonym  Source
(3β,4β,25R)-cholest-5-ene-3,4,26-triolIUPAC
UniProt Name  Source
(25R)-4β,26-dihydroxycholesterolUniProt
Citations