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CHEBI:87677 - (25R)-3β-hydroxycholest-5-en-7-one-26-al

ChEBI IDCHEBI:87677
ChEBI Name(25R)-3β-hydroxycholest-5-en-7-one-26-al
Stars
ASCII Name(25R)-3beta-hydroxycholest-5-en-7-one-26-al
DefinitionA 26-oxo steroid resulting from the oxidation of (25R)-3β,26-dihydroxycholest-5-en-7-one to the corresponding aldehyde.
Last Modified25 April 2017
Submitternhn
DownloadsMolfile
FormulaC27H42O3
Net Charge0
Average Mass414.630
Monoisotopic Mass414.31340
SMILES[H]C(=O)[C@H](C)CCC[C@@H](C)[C@@]1([H])CC[C@]2([H])[C@]1(C)CC[C@@]1([H])[C@@]2([H])C(=O)C=C2C[C@@H](O)CC[C@@]21C
InChIInChI=1S/C27H42O3/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/h15-18,20-23,25,29H,5-14H2,1-4H3/t17-,18-,20+,21-,22+,23+,25+,26+,27-/m1/s1
InChIKeyQIBLFDGXKLKYFD-HNFKANRHSA-N
ChEBI Ontology
Outgoing Relation(s)
(25R)-3β-hydroxycholest-5-en-7-one-26-al (CHEBI:87677) has functional parent cholesterol (CHEBI:16113)
(25R)-3β-hydroxycholest-5-en-7-one-26-al (CHEBI:87677) is a 26-oxo steroid (CHEBI:36884)
(25R)-3β-hydroxycholest-5-en-7-one-26-al (CHEBI:87677) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722)
(25R)-3β-hydroxycholest-5-en-7-one-26-al (CHEBI:87677) is a 3β-sterol (CHEBI:35348)
(25R)-3β-hydroxycholest-5-en-7-one-26-al (CHEBI:87677) is a 7-oxo steroid (CHEBI:47789)
(25R)-3β-hydroxycholest-5-en-7-one-26-al (CHEBI:87677) is a cholestanoid (CHEBI:50401)
(25R)-3β-hydroxycholest-5-en-7-one-26-al (CHEBI:87677) is a oxysterol (CHEBI:53030)
(25R)-3β-hydroxycholest-5-en-7-one-26-al (CHEBI:87677) is a steroid aldehyde (CHEBI:131565)
IUPAC Name 
(25R)-3β-hydroxy-7-oxocholest-5-en-26-al
Synonym  Source
(3β,25R)-3-hydroxy-7-oxocholest-5-en-26-alIUPAC
UniProt Name  Source
(25R)-3β-hydroxycholest-5-en-7-one-26-alUniProt