CHEBI:145048 - epiandrosterone 3-β-D-glucoside

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ChEBI Name epiandrosterone 3-β-D-glucoside
ChEBI ID CHEBI:145048
ChEBI ASCII Name epiandrosterone 3-beta-D-glucoside
Definition A sterol 3-β-D-glucoside that has epiandrosterone as the sterol component.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C25H40O7
Net Charge 0
Average Mass 452.588
Monoisotopic Mass 452.27740
InChI InChI=1S/C25H40O7/c1-24-9-7-14(31-23-22(30)21(29)20(28)18(12-26)32-23)11-13(24)3-4-15-16-5-6-19(27)25(16,2)10-8-17(15)24/h13-18,20-23,26,28-30H,3-12H2,1-2H3/t13-,14-,15-,16-,17-,18+,20+,21-,22+,23+,24-,25-/m0/s1
InChIKey KNJIBCLNEUIEHR-ZZYATJHVSA-N
SMILES C1[C@@H](C[C@@]2(CC[C@]3([C@]4([C@](CC[C@@]3([C@@]2(C)C1)[H])(C(CC4)=O)C)[H])[H])[H])O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing epiandrosterone 3-β-D-glucoside (CHEBI:145048) has functional parent epiandrosterone (CHEBI:541975)
epiandrosterone 3-β-D-glucoside (CHEBI:145048) is a 17-oxo steroid (CHEBI:19168)
epiandrosterone 3-β-D-glucoside (CHEBI:145048) is a monosaccharide derivative (CHEBI:63367)
epiandrosterone 3-β-D-glucoside (CHEBI:145048) is a sterol 3-β-D-glucoside (CHEBI:37424)
IUPAC Name
17-oxo-5α-androstan-3β-yl β-D-glucopyranoside
Synonyms Sources
3β-hydroxy-5α-androstan-17-one 3-β-D-glucoside SUBMITTER
epiandrosterone 3-β-D-glucoside UniProt
Last Modified
31 October 2019