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CHEBI:190024 - Cl-Amidine

ChEBI IDCHEBI:190024
ChEBI NameCl-Amidine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H19ClN4O2
Net Charge0
Average Mass310.785
Monoisotopic Mass310.11965
SMILESNC(=O)[C@H](CCC/N=C(/N)CCl)NC(=O)c1ccccc1
InChIInChI=1S/C14H19ClN4O2/c15-9-12(16)18-8-4-7-11(13(17)20)19-14(21)10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H2,16,18)(H2,17,20)(H,19,21)/t11-/m0/s1
InChIKeyBPWATVWOHQZVRP-NSHDSACASA-N
Species of MetaboliteComponentSourceComments
Brassica napus (ncbitaxon:3708) flower (BTO:0000469) MetaboLights (MTBLS3950)
ChEBI Ontology
Outgoing Relation(s)
Cl-Amidine (CHEBI:190024) is a benzenes (CHEBI:22712)
IUPAC Name 
N-[(2S)-1-amino-5-[(1-amino-2-chloroethylidene)amino]-1-oxopentan-2-yl]benzamide
Manual XrefsDatabases
28487993ChemSpider