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CHEBI:76592 - (25R)-7α,26-dihydroxycholesterol

ChEBI IDCHEBI:76592
ChEBI Name(25R)-7α,26-dihydroxycholesterol
Stars
ASCII Name(25R)-7alpha,26-dihydroxycholesterol
DefinitionA 7α,26-dihydroxycholesterol that has R configuration at position 25.
Last Modified25 April 2017
SubmitterKAX
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)CCC[C@@H](C)CO)[C@]1([H])[C@H](O)C=C1C[C@@H](O)CC[C@@]12C
InChIInChI=1S/C27H46O3/c1-17(16-28)6-5-7-18(2)21-8-9-22-25-23(11-13-27(21,22)4)26(3)12-10-20(29)14-19(26)15-24(25)30/h15,17-18,20-25,28-30H,5-14,16H2,1-4H3/t17-,18-,20+,21-,22+,23+,24-,25+,26+,27-/m1/s1
InChIKeyRXMHNAKZMGJANZ-GNENNHQYSA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
(25R)-7α,26-dihydroxycholesterol (CHEBI:76592) is a 7α,26-dihydroxycholesterol (CHEBI:18431)
IUPAC Name 
(25R)-cholest-5-ene-3β,7α,26-triol
Synonym  Source
(3β,7α,25R)-cholest-5-ene-3,7,26-triolChEBI
UniProt Name  Source
(25R)-cholest-5-en-3β,7α,26-triolUniProt
Registry NumbersSources
Reaxys:8369973Reaxys