Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LL7I3R
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Ligand Name |
4-{[3-Chloro-4-(Alpha-D-Mannopyranosyloxy)phenyl]carbamoyl}benzoic Acid
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Synonyms |
4-{[3-Chloro-4-(Alpha-D-Mannopyranosyloxy)phenyl]carbamoyl}benzoic Acid; Q27454227; 3XJ
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Structure |
Download2D MOL |
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Formula |
C20H20ClNO9
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Canonical SMILES |
C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)OC3C(C(C(C(O3)CO)O)O)O)Cl)C(=O)O
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InChI |
1S/C20H20ClNO9/c21-12-7-11(22-18(27)9-1-3-10(4-2-9)19(28)29)5-6-13(12)30-20-17(26)16(25)15(24)14(8-23)31-20/h1-7,14-17,20,23-26H,8H2,(H,22,27)(H,28,29)/t14-,15-,16+,17+,20+/m1/s1
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InChIKey |
HIKPKPMJGGGESU-BAPGRXHISA-N
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PubChem Compound ID |
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