CHEBI:65137 - N-hydroxydebrisoquine O-glucuronide

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ChEBI Name N-hydroxydebrisoquine O-glucuronide ChEBI ID CHEBI:65137 ChEBI ASCII Name N-hydroxydebrisoquine O-glucuronide Definition A glucosiduronic acid that is the O-β-D-glucuronide conjugate of N-hydroxydebrisoquine. Stars This entity has been manually annotated by the ChEBI Team. Submitter Bijay Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C16H21N3O7 Net Charge 0 Average Mass 367.35380 Monoisotopic Mass 367.13795 InChI InChI=1S/C16H21N3O7/c17-16(19-6-5-8-3-1-2-4-9(8)7-19)18-26-15-12(22)10(20)11(21)13(25-15)14(23)24/h1-4,10-13,15,20-22H,5-7H2,(H2,17,18)(H,23,24)/t10-,11-,12+,13-,15-/m0/s1 InChIKey IOVMNRAFAPHDOK-AIUMHDJVSA-N SMILES NC(=NO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)N1CCc2ccccc2C1 ChEBI Ontology Outgoing N-hydroxydebrisoquine O-glucuronide (CHEBI:65137) has functional parent debrisoquin (CHEBI:34665) N-hydroxydebrisoquine O-glucuronide (CHEBI:65137) is a glucosiduronic acid (CHEBI:24302) N-hydroxydebrisoquine O-glucuronide (CHEBI:65137) is a guanidines (CHEBI:24436) IUPAC Name 1-O-{-[amino(3,4-dihydroisoquinolin-2(1H)-yl)methylene]amino}-β-D-glucopyranuronic acid Citation Type Source 16033947 PubMed citation Europe PMC Last Modified 11 July 2012