CHEBI:80581 - Morphine-6-glucuronide

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ChEBI Name Morphine-6-glucuronide
ChEBI ID CHEBI:80581
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H27NO9
Net Charge 0
Average Mass 461.46180
Monoisotopic Mass 461.169
InChI InChI=1S/C23H27NO9/c1-24-7-6-23-10-3-5-13(31-22-17(28)15(26)16(27)19(33-22)21(29)30)20(23)32-18-12(25)4-2-9(14(18)23)8-11(10)24/h2-5,10-11,13,15-17,19-20,22,25-28H,6-8H2,1H3,(H,29,30)/t10-,11+,13-,15-,16-,17+,19-,20-,22+,23-/m0/s1
InChIKey GNJCUHZOSOYIEC-GAROZEBRSA-N
SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)ccc5O
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 alkaloid )
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ChEBI Ontology
Outgoing Morphine-6-glucuronide (CHEBI:80581) is a morphinane alkaloid (CHEBI:25418)
Manual Xref Database
C16578 KEGG COMPOUND
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Registry Number Type Source
20290-10-2 CAS Registry Number KEGG COMPOUND