Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L7VU2W
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| Ligand Name |
(R)-4-(((S)-1-(((S)-1-Amino-4-Carboxy-1-Oxobutan-2-Yl)amino)-4-Carboxy-1-Oxobutan-2-Yl)amino)-3-((3-(3'-Chloro-[1,1'-Biphenyl]-4-Yl)isoxazol-5-Yl)methyl)-4-Oxobutanoate
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| Synonyms |
(R)-4-(((S)-1-(((S)-1-Amino-4-Carboxy-1-Oxobutan-2-Yl)amino)-4-Carboxy-1-Oxobutan-2-Yl)amino)-3-((3-(3'-Chloro-[1,1'-Biphenyl]-4-Yl)isoxazol-5-Yl)methyl)-4-Oxobutanoate; CHEMBL4099825; Q27455488; 55L
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| Structure |
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Download2D MOL
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| Formula |
C30H31ClN4O10
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| Canonical SMILES |
C1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)C3=NOC(=C3)CC(CC(=O)O)C(=O)NC(CCC(=O)O)C(=O)NC(CCC(=O)O)C(=O)N
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| InChI |
1S/C30H31ClN4O10/c31-20-3-1-2-18(12-20)16-4-6-17(7-5-16)24-15-21(45-35-24)13-19(14-27(40)41)29(43)34-23(9-11-26(38)39)30(44)33-22(28(32)42)8-10-25(36)37/h1-7,12,15,19,22-23H,8-11,13-14H2,(H2,32,42)(H,33,44)(H,34,43)(H,36,37)(H,38,39)(H,40,41)/t19-,22+,23+/m1/s1
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| InChIKey |
IXVAVGNSYYZTEW-OIBXWCBGSA-N
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| PubChem Compound ID | ||||
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