CHEBI:145051 - dehydroepiandrosterone 3-β-D-glucoside

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name dehydroepiandrosterone 3-β-D-glucoside
ChEBI ID CHEBI:145051
ChEBI ASCII Name dehydroepiandrosterone 3-beta-D-glucoside
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C25H38O7
Net Charge 0
Average Mass 450.572
Monoisotopic Mass 450.26175
InChI InChI=1S/C25H38O7/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/h3,14-18,20-23,26,28-30H,4-12H2,1-2H3/t14-,15-,16-,17-,18+,20+,21-,22+,23+,24-,25-/m0/s1
InChIKey MPVTUSBXPNOQNU-YLACOBMXSA-N
SMILES C1[C@@H](CC2=CC[C@]3([C@]4([C@](CC[C@@]3([C@@]2(C)C1)[H])(C(CC4)=O)C)[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 dehydroepiandrosterone 3-β-D-glucoside (CHEBI:145051) has functional parent dehydroepiandrosterone (CHEBI:28689)
dehydroepiandrosterone 3-β-D-glucoside (CHEBI:145051) is a monosaccharide derivative (CHEBI:63367)
dehydroepiandrosterone 3-β-D-glucoside (CHEBI:145051) is a sterol 3-β-D-glucoside (CHEBI:37424)
Synonyms Sources
3β-hydroxyandrost-5-en-17-one 3-β-D-glucoside SUBMITTER
dehydroepiandrosterone 3-β-D-glucoside UniProt
Citation Waiting for Citations Type Source
25888493 PubMed citation SUBMITTER