CHEBI:86145 - (7α,22R)-dihydroxycholesterol

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ChEBI Name (7α,22R)-dihydroxycholesterol
ChEBI ID CHEBI:86145
ChEBI ASCII Name (7alpha,22R)-dihydroxycholesterol
Definition An oxysterol that is cholesterol which is substituted by hydroxy groups at positions 7α and 22R.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
Download Molfile XML SDF
Formula C27H46O3
Net Charge 0
Average Mass 418.65230
Monoisotopic Mass 418.345
InChI InChI=1S/C27H46O3/c1-16(2)6-9-23(29)17(3)20-7-8-21-25-22(11-13-27(20,21)5)26(4)12-10-19(28)14-18(26)15-24(25)30/h15-17,19-25,28-30H,6-14H2,1-5H3/t17-,19-,20+,21-,22-,23+,24+,25-,26-,27+/m0/s1
InChIKey ULLWYOKOOHAYDJ-SDLILUQASA-N
SMILES CC(C)CC[C@@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing (7α,22R)-dihydroxycholesterol (CHEBI:86145) is a 22-hydroxy steroid (CHEBI:36863)
(7α,22R)-dihydroxycholesterol (CHEBI:86145) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722)
(7α,22R)-dihydroxycholesterol (CHEBI:86145) is a 7α-hydroxy steroid (CHEBI:36843)
(7α,22R)-dihydroxycholesterol (CHEBI:86145) is a cholestanoid (CHEBI:50401)
(7α,22R)-dihydroxycholesterol (CHEBI:86145) is a oxysterol (CHEBI:53030)
IUPAC Name
cholest-5-ene-3β,7α,22R-triol
Synonyms Sources
(22R,7α)-dihydroxycholesterol UniProt
(3β,7α,22R)-cholest-5-ene-3,7,22-triol IUPAC
7α,22R-dihydroxycholesterol ChEBI
Cholest-5-ene-3,7,22-triol ChemIDplus
Registry Numbers Types Sources
104786-66-5 CAS Registry Number ChemIDplus
5300002 Reaxys Registry Number Reaxys
Last Modified
25 April 2017