Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LGP1E2
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| Ligand Name |
(3S,4S)-2-(4-tert-butylphenyl)-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
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| Synonyms |
CHEMBL4444823; (3S,4S)-2-(4-tert-butylphenyl)-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid; BDBM50521325; K5P
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| Structure |
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Download2D MOL |
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| Formula |
C27H27NO4
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| Canonical SMILES |
CC(C)(C)C1=CC=C(C=C1)N2C(C(C3=CC=CC=C3C2=O)C(=O)O)C4=CC=C(C=C4)OC
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| InChI |
1S/C27H27NO4/c1-27(2,3)18-11-13-19(14-12-18)28-24(17-9-15-20(32-4)16-10-17)23(26(30)31)21-7-5-6-8-22(21)25(28)29/h5-16,23-24H,1-4H3,(H,30,31)/t23-,24+/m0/s1
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| InChIKey |
VLZBEPGIJKIYGT-BJKOFHAPSA-N
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| PubChem Compound ID | ||||
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