CHEBI:231360 - (R)-(-)-niguldipine hydrochloride

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name (R)-(-)-niguldipine hydrochloride
ChEBI ID CHEBI:231360
Definition (R)-(-)-niguldipine hydrochloride is a L-type Ca2+ channel blocker and alpha1A-adrenoceptor antagonist; less active enantiomer.
Stars This entity has been manually annotated by a third party.
Submitter Delphine Zhou
Supplier Information
Download Molfile XML SDF
Formula C36H39N3O6.ClH
Net Charge 0
Average Mass 646.180
Monoisotopic Mass 645.26056
InChI InChI=1S/C36H39N3O6.ClH/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;1H/t33-;/m1./s1
InChIKey MHOSUIMBPQVOEU-MGDILKBHSA-N
SMILES O=C(OC)C1=C(C)NC(C)=C(C(OCCCN2CCC(C3=CC=CC=C3)(C4=CC=CC=C4)CC2)=O)[C@@H]1C5=CC=CC([N+]([O-])=O)=C5.Cl
ChEBI Ontology
Outgoing (R)-(-)-niguldipine hydrochloride (CHEBI:231360) is a organic molecular entity (CHEBI:50860)
Registry Number Type Source
113145-70-3 CAS Registry Number SUBMITTER