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CHEBI:7450 - Nafenopin glucuronide

ChEBI IDCHEBI:7450
ChEBI NameNafenopin glucuronide
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC26H30O9
Net Charge0
Average Mass486.517
Monoisotopic Mass486.18898
SMILESCC(C)(Oc1ccc(C2CCCc3ccccc32)cc1)C(=O)O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C26H30O9/c1-26(2,25(32)34-24-21(29)19(27)20(28)22(33-24)23(30)31)35-16-12-10-15(11-13-16)18-9-5-7-14-6-3-4-8-17(14)18/h3-4,6,8,10-13,18-22,24,27-29H,5,7,9H2,1-2H3,(H,30,31)/t18?,19-,20-,21+,22-,24-/m0/s1
InChIKeyJGFJGYHYYUXOAR-OWOUXODFSA-N
ChEBI Ontology
Outgoing Relation(s)
Nafenopin glucuronide (CHEBI:7450) is a glucosiduronic acid (CHEBI:24302)
Synonym  Source
Nafenopin glucuronideKEGG COMPOUND
Manual XrefsDatabases
C11608KEGG COMPOUND