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CHEBI:234254 - monohydroxylated nifedipine

ChEBI IDCHEBI:234254
ChEBI Namemonohydroxylated nifedipine
Stars
DefinitionA nifedipine metabolite arising from hydroxylation of one of the methyl group attached to the pyridine.
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC17H18N2O7
Net Charge0
Average Mass362.338
Monoisotopic Mass362.11140
SMILESCOC(=O)C1=C(C)NC(CO)=C(C(=O)OC)C1c1ccccc1[N+](=O)[O-]
InChIInChI=1S/C17H18N2O7/c1-9-13(16(21)25-2)14(10-6-4-5-7-12(10)19(23)24)15(17(22)26-3)11(8-20)18-9/h4-7,14,18,20H,8H2,1-3H3
InChIKeyKERNBXOJWUHRFF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
monohydroxylated nifedipine (CHEBI:234254) is a dihydropyridine (CHEBI:50075)
Synonym  Source
hnifedipineSUBMITTER