Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4KRA3
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| Ligand Name |
8-[(1r)-2-{[1,1-Dimethyl-2-(2-Methylphenyl)ethyl]amino}-1-Hydroxyethyl]-5-Hydroxy-2h-1,4-Benzoxazin-3(4h)-One
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| Synonyms |
CHEMBL1615159; 8-[(1r)-2-{[1,1-Dimethyl-2-(2-Methylphenyl)ethyl]amino}-1-Hydroxyethyl]-5-Hydroxy-2h-1,4-Benzoxazin-3(4h)-One; P0G; BDBM50569860; Q27464220
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| Structure |
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Download2D MOL |
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| Formula |
C21H26N2O4
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| Canonical SMILES |
CC1=CC=CC=C1CC(C)(C)NCC(C2=C3C(=C(C=C2)O)NC(=O)CO3)O
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| InChI |
1S/C21H26N2O4/c1-13-6-4-5-7-14(13)10-21(2,3)22-11-17(25)15-8-9-16(24)19-20(15)27-12-18(26)23-19/h4-9,17,22,24-25H,10-12H2,1-3H3,(H,23,26)/t17-/m0/s1
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| InChIKey |
NWQXBEWHTDRJIP-KRWDZBQOSA-N
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| PubChem Compound ID | ||||
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