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CHEBI:231367 - WIN 64338 hydrochloride

Default Structure
ChEBI IDCHEBI:231367
ChEBI NameWIN 64338 hydrochloride
Stars
DefinitionWIN 64338 hydrochloride is a potent, selective, nonpeptide competitive antagonist of bradykinin B2 receptor.
Submitterdelphine
DownloadsMolfile
FormulaC45H68N4OP.Cl.HCl
Net Charge0
Average Mass783.954
Monoisotopic Mass782.45860
SMILESCCCC[P+](CCCC)(CCCC)Cc1ccc(NC(=O)[C@H](Cc2ccc3ccccc3c2)N/C(=N/C2CCCCC2)NC2CCCCC2)cc1.Cl.[Cl-]
InChIInChI=1S/C45H67N4OP.2ClH/c1-4-7-30-51(31-8-5-2,32-9-6-3)35-36-25-28-42(29-26-36)46-44(50)43(34-37-24-27-38-18-16-17-19-39(38)33-37)49-45(47-40-20-12-10-13-21-40)48-41-22-14-11-15-23-41;;/h16-19,24-29,33,40-41,43H,4-15,20-23,30-32,34-35H2,1-3H3,(H2-,46,47,48,49,50);2*1H/t43-;;/m0../s1
InChIKeyYYJGBEZPVOUBMJ-KRFCICRISA-N
ChEBI Ontology
Outgoing Relation(s)
WIN 64338 hydrochloride (CHEBI:231367) is a organic molecular entity (CHEBI:50860)
Synonym  Source
WIN 64338SUBMITTER
Registry NumbersSources
CAS:163727-74-0SUBMITTER