CHEBI:31911 - Nilvadipine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Nilvadipine
ChEBI ID CHEBI:31911
Stars This entity has been manually annotated by a third party.
Secondary ChEBI IDs CHEBI:95208
Supplier Information
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Formulae C19H19N3O6
C19H19N3O6
C19H19N3O6
Net Charge 0
Average Mass 385.371
Monoisotopic Mass 385.12739
InChI InChI=1S/C19H19N3O6/c1-10(2)28-19(24)15-11(3)21-14(9-20)17(18(23)27-4)16(15)12-6-5-7-13(8-12)22(25)26/h5-8,10,16,21H,1-4H3
InChIKey FAIIFDPAEUKBEP-UHFFFAOYSA-N
SMILES CC1=C(C(C(=C(N1)C#N)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C
ChEBI Ontology
Outgoing Nilvadipine (CHEBI:31911) is a dihydropyridine (CHEBI:50075)
Nilvadipine (CHEBI:31911) is a isopropyl ester (CHEBI:35725)
Nilvadipine (CHEBI:31911) is a methyl ester (CHEBI:25248)
Nilvadipine (CHEBI:31911) is a nitrile (CHEBI:18379)
Synonyms Sources
FR-34235 DrugCentral
Nilvadipine KEGG COMPOUND
nivadil DrugCentral
nivaldipine DrugCentral
Manual Xrefs Databases
1934 DrugCentral
D01908 KEGG DRUG
HMDB0015657 HMDB
LSM-6501 LINCS
View more database links
Registry Number Type Source
75530-68-6 CAS Registry Number DrugCentral
Last Modified
09 March 2018