Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1ODX8
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| Ligand Name |
3-[(E)-2-(2-chloro-4-{[3-{[(R)-(2,6-dichlorophenyl)(hydroxy)-lambda~4~-sulfanyl]methyl}-5-(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)ethenyl]benzoic acid
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| Synonyms |
3-[(E)-2-(2-chloro-4-{[3-{[(R)-(2,6-dichlorophenyl)(hydroxy)-lambda~4~-sulfanyl]methyl}-5-(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)ethenyl]benzoic acid
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| Structure |
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Download2D MOL |
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| Formula |
C29H24Cl3NO5S
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| Canonical SMILES |
CC(C)C1=C(C(=NO1)CS(=O)C2=C(C=CC=C2Cl)Cl)COC3=CC(=C(C=C3)C=CC4=CC(=CC=C4)C(=O)O)Cl
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| InChI |
1S/C29H24Cl3NO5S/c1-17(2)27-22(26(33-38-27)16-39(36)28-23(30)7-4-8-24(28)31)15-37-21-12-11-19(25(32)14-21)10-9-18-5-3-6-20(13-18)29(34)35/h3-14,17H,15-16H2,1-2H3,(H,34,35)/b10-9+/t39-/m1/s1
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| InChIKey |
QMDSMBFIKFKGBD-DDNMZLIESA-N
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| PubChem Compound ID | ||||
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