CHEBI:31331 - Cadralazine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Cadralazine
ChEBI ID CHEBI:31331
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C12H21N5O3
C12H21N5O3
Net Charge 0
Average Mass 283.327
Monoisotopic Mass 283.16444
InChI InChI=1S/C12H21N5O3/c1-4-17(8-9(3)18)11-7-6-10(13-15-11)14-16-12(19)20-5-2/h6-7,9,18H,4-5,8H2,1-3H3,(H,13,14)(H,16,19)
InChIKey QLTVVOATEHFXLT-UHFFFAOYSA-N
SMILES N(CC(C)O)(CC)C1=CC=C(N=N1)NNC(OCC)=O
ChEBI Ontology
Outgoing Cadralazine (CHEBI:31331) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
cadral DrugCentral
Cadralazine KEGG COMPOUND
cadraten DrugCentral
cadrilan DrugCentral
Manual Xrefs Databases
461 DrugCentral
D01804 KEGG DRUG
HMDB0041845 HMDB
View more database links
Registry Number Type Source
64241-34-5 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017