CHEBI:231367 - WIN 64338 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 WIN 64338 hydrochloride
ChEBI ID CHEBI:231367
Definition WIN 64338 hydrochloride is a potent, selective, nonpeptide competitive antagonist of bradykinin B2 receptor.
Stars This entity has been manually annotated by a third party.
Submitter Delphine Zhou
Supplier Information
Download Molfile XML SDF
Formula C45H68N4OP.ClH.Cl
Net Charge 0
Average Mass 783.950
Monoisotopic Mass 782.45861
InChI InChI=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
InChIKey YYJGBEZPVOUBMJ-KRFCICRISA-N
SMILES CCCC[P+](CCCC)(CCCC)CC1=CC=C(C=C1)NC(=O)[C@H](CC2=CC3=CC=CC=C3C=C2)N/C(=N/C4CCCCC4)/NC5CCCCC5.Cl.[Cl-]
ChEBI Ontology
Outgoing WIN 64338 hydrochloride (CHEBI:231367) is a organic molecular entity (CHEBI:50860)
Synonym Source
WIN 64338 SUBMITTER
Registry Number Type Source
163727-74-0 CAS Registry Number SUBMITTER