Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LF79DV
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| Ligand Name |
6-{[(2s,5r,6r)-4-[(1s)-2-(Tert-Butylsulfonyl)-1-Cyclopropylethyl]-6-(3-Chlorophenyl)-5-(4-Chlorophenyl)-2-Methyl-3-Oxomorpholin-2-Yl]methyl}pyridine-3-Carboxylic Acid
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| Synonyms |
CHEMBL3236665; 6-{[(2s,5r,6r)-4-[(1s)-2-(Tert-Butylsulfonyl)-1-Cyclopropylethyl]-6-(3-Chlorophenyl)-5-(4-Chlorophenyl)-2-Methyl-3-Oxomorpholin-2-Yl]methyl}pyridine-3-Carboxylic Acid; 4odf; SCHEMBL16125872; BDBM50008819; Q27453275; 2U1; 6-(((2S,5R,6R)-4-((S)-2-(tert-Butylsulfonyl)-1-cyclopropylethyl)-6-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methyl-3-oxomorpholin-2-yl)methyl)nicotinic acid
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| Structure |
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Download2D MOL |
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| Formula |
C33H36Cl2N2O6S
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| Canonical SMILES |
CC1(C(=O)N(C(C(O1)C2=CC(=CC=C2)Cl)C3=CC=C(C=C3)Cl)C(CS(=O)(=O)C(C)(C)C)C4CC4)CC5=NC=C(C=C5)C(=O)O
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| InChI |
1S/C33H36Cl2N2O6S/c1-32(2,3)44(41,42)19-27(20-8-9-20)37-28(21-10-13-24(34)14-11-21)29(22-6-5-7-25(35)16-22)43-33(4,31(37)40)17-26-15-12-23(18-36-26)30(38)39/h5-7,10-16,18,20,27-29H,8-9,17,19H2,1-4H3,(H,38,39)/t27-,28-,29-,33+/m1/s1
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| InChIKey |
OTQRFDJHHZHHNT-LNHQPZRBSA-N
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| PubChem Compound ID | ||||
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