CHEBI:133504 - etiocholanolone 3-glucuronide

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ChEBI Name etiocholanolone 3-glucuronide
ChEBI ID CHEBI:133504
Definition A steroid glucosiduronic acid having etiocholanolone as the steroid component.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C25H38O8
Net Charge 0
Average Mass 466.565
Monoisotopic Mass 466.25667
InChI InChI=1S/C25H38O8/c1-24-9-7-13(32-23-20(29)18(27)19(28)21(33-23)22(30)31)11-12(24)3-4-14-15-5-6-17(26)25(15,2)10-8-16(14)24/h12-16,18-21,23,27-29H,3-11H2,1-2H3,(H,30,31)/t12-,13+,14+,15+,16+,18+,19+,20-,21+,23-,24+,25+/m1/s1
InChIKey VFUIRAVTUVCQTF-GYFJWSTRSA-N
SMILES C1[C@]2([C@]([C@]3([C@@](C(CC3)=O)(C1)C)[H])(CC[C@]4([C@@]2(CC[C@@H](C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(O)=O)O)O)O)C)[H])[H])[H]
Metabolite of Species Details
Clarias gariepinus (NCBI:txid13013) See: PubMed
Homo sapiens (NCBI:txid9606) See: PubMed
Roles Classification
Biological Role(s): human blood serum metabolite
Any metabolite (endogenous or exogenous) found in human blood serum samples.
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
marine xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing etiocholanolone 3-glucuronide (CHEBI:133504) has role human blood serum metabolite (CHEBI:85234)
etiocholanolone 3-glucuronide (CHEBI:133504) has role human urinary metabolite (CHEBI:84087)
etiocholanolone 3-glucuronide (CHEBI:133504) has role human xenobiotic metabolite (CHEBI:76967)
etiocholanolone 3-glucuronide (CHEBI:133504) has role marine xenobiotic metabolite (CHEBI:83399)
etiocholanolone 3-glucuronide (CHEBI:133504) is a 17-oxo steroid (CHEBI:19168)
etiocholanolone 3-glucuronide (CHEBI:133504) is a steroid glucosiduronic acid (CHEBI:26763)
etiocholanolone 3-glucuronide (CHEBI:133504) is conjugate acid of etiocholanolone 3-glucuronide(1−) (CHEBI:133505)
Incoming etiocholanolone 3-glucuronide(1−) (CHEBI:133505) is conjugate base of etiocholanolone 3-glucuronide (CHEBI:133504)
IUPAC Name
17-oxo-5β-androstan-3β-yl β-D-glucopyranosiduronic acid
Synonyms Sources
(3β,5β)-17-oxoandrostan-3-yl β-D-glucopyranosiduronic acid IUPAC
etiocholanolone 3-β-D-glucuronide ChEBI
etiocholanolone 3-β-glucuronide ChEBI
etiocholanolone 3-O-β-D-glucuronide ChEBI
etiocholanolone glucuronide ChEBI
Manual Xref Database
HMDB0004484 HMDB
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Citations Waiting for Citations Types Sources
10759475 PubMed citation Europe PMC
12051338 PubMed citation Europe PMC
13742168 PubMed citation Europe PMC
21742123 PubMed citation Europe PMC
25609240 PubMed citation Europe PMC
25701608 PubMed citation Europe PMC
2937683 PubMed citation Europe PMC
7440707 PubMed citation Europe PMC
7962311 PubMed citation Europe PMC
Last Modified
29 September 2016