CHEBI:7572 - Niguldipine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Niguldipine
ChEBI ID CHEBI:7572
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C36H39N3O6
C36H39N3O6
Net Charge 0
Average Mass 609.713
Monoisotopic Mass 609.28389
InChI InChI=1S/C36H39N3O6/c1-25-31(34(40)44-3)33(27-12-10-17-30(24-27)39(42)43)32(26(2)37-25)35(41)45-23-11-20-38-21-18-36(19-22-38,28-13-6-4-7-14-28)29-15-8-5-9-16-29/h4-10,12-17,24,33,37H,11,18-23H2,1-3H3
InChIKey SVJMLYUFVDMUHP-UHFFFAOYSA-N
SMILES COC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OCCCN1CCC(CC1)(c1ccccc1)c1ccccc1
ChEBI Ontology
Outgoing Niguldipine (CHEBI:7572) is a diarylmethane (CHEBI:51614)
Synonyms Sources
Dexniguldipine KEGG COMPOUND
Niguldipine KEGG COMPOUND
Manual Xrefs Databases
C11236 KEGG COMPOUND
LSM-1688 LINCS
View more database links
Registry Number Type Source
102993-22-6 CAS Registry Number KEGG COMPOUND
Last Modified
24 February 2016