CHEBI:155845 - 25-hydroxycholest-4-en-3-one

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ChEBI Name 25-hydroxycholest-4-en-3-one
ChEBI ID CHEBI:155845
Definition A cholestanoid that is cholest-4-en-3-one which carries a hydroxy group at position 25.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C27H44O2
Net Charge 0
Average Mass 400.647
Monoisotopic Mass 400.33413
InChI InChI=1S/C27H44O2/c1-18(7-6-14-25(2,3)29)22-10-11-23-21-9-8-19-17-20(28)12-15-26(19,4)24(21)13-16-27(22,23)5/h17-18,21-24,29H,6-16H2,1-5H3/t18-,21+,22-,23+,24+,26+,27-/m1/s1
InChIKey APRTUYUNMHTWBF-REEZCCHISA-N
SMILES [C@]12([C@]([C@]3([C@](CC1)([C@@]4(C(=CC(CC4)=O)CC3)C)[H])[H])(CC[C@@]2([C@@H](CCCC(C)(C)O)C)[H])[H])C
Metabolite of Species Details
Sterolibacterium denitrificans (NCBI:txid157592) See: PubMed
Roles Classification
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
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ChEBI Ontology
Outgoing 25-hydroxycholest-4-en-3-one (CHEBI:155845) has functional parent cholest-4-en-3-one (CHEBI:16175)
25-hydroxycholest-4-en-3-one (CHEBI:155845) has role bacterial metabolite (CHEBI:76969)
25-hydroxycholest-4-en-3-one (CHEBI:155845) is a 25-hydroxy steroid (CHEBI:36864)
25-hydroxycholest-4-en-3-one (CHEBI:155845) is a 3-oxo-Δ4 steroid (CHEBI:47909)
25-hydroxycholest-4-en-3-one (CHEBI:155845) is a cholestanoid (CHEBI:50401)
IUPAC Name
25-hydroxycholest-4-en-3-one
Synonyms Sources
25-hydroxy-4-cholesten-3-one ChEBI
25-hydroxycholest-4-en-3-one UniProt
cholest-4-en-25-ol-3-one ChEBI
Manual Xref Database
CPD-23331 MetaCyc
View more database links
Citations Waiting for Citations Types Sources
12777473 PubMed citation Europe PMC
18039763 PubMed citation SUBMITTER
20224941 PubMed citation Europe PMC
27726023 PubMed citation Europe PMC
29573289 PubMed citation Europe PMC
31902650 PubMed citation Europe PMC
6492802 PubMed citation Europe PMC
Last Modified
17 June 2020