WIN 64338   Click here for help

GtoPdb Ligand ID: 677

Synonyms: WIN-64338
Compound class: Synthetic organic
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2D Structure
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SMILES / InChI / InChIKey
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Canonical SMILES CCCC[P+](Cc1ccc(cc1)NC(=O)C(Cc1ccc2c(c1)cccc2)NC(=NC1CCCCC1)NC1CCCCC1)(CCCC)CCCC.[Cl-]
Isomeric SMILES CCCC[P+](Cc1ccc(cc1)NC(=O)[C@H](Cc1ccc2c(c1)cccc2)NC(=NC1CCCCC1)NC1CCCCC1)(CCCC)CCCC.[Cl-]
InChI InChI=1S/C45H67N4OP.ClH/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);1H/t43-;/m0./s1
InChI Key MJWYKJXHACNJCD-SXWPEPABSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
tributyl-[[4-[[(2S)-2-[(N,N'-dicyclohexylcarbamimidoyl)amino]-3-naphthalen-2-ylpropanoyl]amino]phenyl]methyl]phosphanium chloride
Synonyms Click here for help
WIN-64338
Database Links Click here for help
CAS Registry No. 151039-63-3 (source: Scifinder)
ChEMBL Ligand CHEMBL551291
GtoPdb PubChem SID 135651328
PubChem CID 132927
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