CHEBI:18431 - 7α,26-dihydroxycholesterol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 7α,26-dihydroxycholesterol
ChEBI ID CHEBI:18431
ChEBI ASCII Name 7alpha,26-dihydroxycholesterol
Definition An oxysterol that is cholesterol which is substituted by hydroxy groups at the 7α and 26 positions.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:2284, CHEBI:12261, CHEBI:20798
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C27H46O3
Net Charge 0
Average Mass 418.65234
Monoisotopic Mass 418.34470
InChI InChI=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
InChIKey RXMHNAKZMGJANZ-DTTSCKGMSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)CO
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 7α,26-dihydroxycholesterol (CHEBI:18431) has functional parent cholesterol (CHEBI:16113)
7α,26-dihydroxycholesterol (CHEBI:18431) has role human metabolite (CHEBI:77746)
7α,26-dihydroxycholesterol (CHEBI:18431) is a 26-hydroxy steroid (CHEBI:36852)
7α,26-dihydroxycholesterol (CHEBI:18431) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722)
7α,26-dihydroxycholesterol (CHEBI:18431) is a 7α-hydroxy steroid (CHEBI:36843)
7α,26-dihydroxycholesterol (CHEBI:18431) is a oxysterol (CHEBI:53030)
7α,26-dihydroxycholesterol (CHEBI:18431) is a triol (CHEBI:27136)
Incoming (25R)-7α,26-dihydroxycholesterol (CHEBI:76592) is a 7α,26-dihydroxycholesterol (CHEBI:18431)
IUPAC Name
cholest-5-ene-3β,7α,26-triol
Synonyms Sources
5-cholestene-3β,7α,26-triol LIPID MAPS
7-alpha,27-Dihydroxycholesterol KEGG COMPOUND
Cholest-5-ene-3beta,7alpha,26-triol KEGG COMPOUND
Cholest-5-ene-3beta,7alpha,27-triol KEGG COMPOUND
Manual Xrefs Databases
C06341 KEGG COMPOUND
LMST04030081 LIPID MAPS
View more database links
Registry Numbers Types Sources
4725-24-0 CAS Registry Number ChemIDplus
6374535 Beilstein Registry Number Beilstein
6374535 Reaxys Registry Number Reaxys
Last Modified
25 April 2017