Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
L3X8BA
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Ligand Name |
2-(2-chlorophenyl)-8-[(3~{R},4~{R})-1-methyl-3-oxidanyl-piperidin-4-yl]-5,7-bis(oxidanyl)chromen-4-one
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Synonyms |
CHEMBL1709089; 2-(2-chlorophenyl)-8-[(3~{R},4~{R})-1-methyl-3-oxidanyl-piperidin-4-yl]-5,7-bis(oxidanyl)chromen-4-one; F9Z; NCGC00014961-02; NCIStruc1_001744; 146426-40-6; BDBM50403757; ZINC18825328
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Structure |
Download2D MOL |
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Formula |
C21H20ClNO5
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Canonical SMILES |
CN1CCC(C(C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=CC=C4Cl)O)O
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InChI |
1S/C21H20ClNO5/c1-23-7-6-12(17(27)10-23)19-14(24)8-15(25)20-16(26)9-18(28-21(19)20)11-4-2-3-5-13(11)22/h2-5,8-9,12,17,24-25,27H,6-7,10H2,1H3/t12-,17-/m0/s1
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InChIKey |
BIIVYFLTOXDAOV-SJCJKPOMSA-N
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PubChem Compound ID |
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