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CHEBI:143795 - Boscalid Glc ac a and b

ChEBI IDCHEBI:143795
ChEBI NameBoscalid Glc ac a and b
Stars
Submittermwilliams
DownloadsMolfile
FormulaC25H22Cl2N2O7
Net Charge0
Average Mass533.364
Monoisotopic Mass532.08041
SMILESCC1OC(Oc2ccc(NC(=O)c3cccnc3Cl)c(-c3ccc(Cl)cc3)c2)C(C(=O)O)C(O)C1O
InChIInChI=1S/C25H22Cl2N2O7/c1-12-20(30)21(31)19(24(33)34)25(35-12)36-15-8-9-18(17(11-15)13-4-6-14(26)7-5-13)29-23(32)16-3-2-10-28-22(16)27/h2-12,19-21,25,30-31H,1H3,(H,29,32)(H,33,34)
InChIKeyDABKKPGPJWJDSJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Boscalid Glc ac a and b (CHEBI:143795) has functional parent boscalid (CHEBI:81822)
Boscalid Glc ac a and b (CHEBI:143795) is a biphenyls (CHEBI:22888)
Boscalid Glc ac a and b (CHEBI:143795) is a monochlorobenzenes (CHEBI:83403)
Boscalid Glc ac a and b (CHEBI:143795) is a pyridinecarboxamide (CHEBI:25529)
Synonym  Source
2-chloro-N-(4'-chloro-5-hydroxybiphenyl-2- yl)nicotinamide conjugated to glucuronic acidSUBMITTER