Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
L69RWE
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Ligand Name |
4-[(6-Chloro-1-Oxo-4-Phenyl-3-Propanoylisoquinolin-2(1h)-Yl)methyl]benzoic Acid
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Synonyms |
CHEMBL259554; 4-[(6-Chloro-1-Oxo-4-Phenyl-3-Propanoylisoquinolin-2(1h)-Yl)methyl]benzoic Acid; SCHEMBL1518740; BDBM50376120; Q27454439; 46C
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Structure |
Download2D MOL |
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Formula |
C26H20ClNO4
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Canonical SMILES |
CCC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4
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InChI |
1S/C26H20ClNO4/c1-2-22(29)24-23(17-6-4-3-5-7-17)21-14-19(27)12-13-20(21)25(30)28(24)15-16-8-10-18(11-9-16)26(31)32/h3-14H,2,15H2,1H3,(H,31,32)
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InChIKey |
ITAZALHTZBIKDO-UHFFFAOYSA-N
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PubChem Compound ID |
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