Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LEJL36
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| Ligand Name |
(2s)-2-Benzyl-3-(4-Propoxy-3-{[({4-[(3s,5s,7s)-Tricyclo[3.3.1.1~3,7~]dec-1-Yl]phenyl}carbonyl)amino]methyl}phenyl)propanoic Acid
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| Synonyms |
CHEMBL1651238; (2s)-2-Benzyl-3-(4-Propoxy-3-{[({4-[(3s,5s,7s)-Tricyclo[3.3.1.1~3,7~]dec-1-Yl]phenyl}carbonyl)amino]methyl}phenyl)propanoic Acid; BDBM50335271; Q27462975; (S)-2-Benzyl-3-(3-(((4-adamantan-1-yl)benzamido)-methyl)-4-propoxyphenyl)propanoic Acid; M7S
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| Structure |
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Download2D MOL |
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| Formula |
C37H43NO4
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| Canonical SMILES |
CCCOC1=C(C=C(C=C1)CC(CC2=CC=CC=C2)C(=O)O)CNC(=O)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5
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| InChI |
1S/C37H43NO4/c1-2-14-42-34-13-8-26(19-31(36(40)41)18-25-6-4-3-5-7-25)20-32(34)24-38-35(39)30-9-11-33(12-10-30)37-21-27-15-28(22-37)17-29(16-27)23-37/h3-13,20,27-29,31H,2,14-19,21-24H2,1H3,(H,38,39)(H,40,41)/t27?,28?,29?,31-,37?/m0/s1
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| InChIKey |
XYMQLACGAYNBRX-KHXABJNDSA-N
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| PubChem Compound ID | ||||
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