Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
L1FGI6
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Ligand Name |
Methyl [(4s,8s)-8-({(2e)-3-[5-Chloro-2-(1h-Tetrazol-1-Yl)phenyl]prop-2-Enoyl}amino)-4-Methyl-2-Oxo-1,3,4,5,6,7,8,10-Octahydro-2h-12,9-(Azeno)-1,10-Benzodiazacyclotetradecin-15-Yl]carbamate
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Synonyms |
CHEMBL4070961; Methyl [(4s,8s)-8-({(2e)-3-[5-Chloro-2-(1h-Tetrazol-1-Yl)phenyl]prop-2-Enoyl}amino)-4-Methyl-2-Oxo-1,3,4,5,6,7,8,10-Octahydro-2h-12,9-(Azeno)-1,10-Benzodiazacyclotetradecin-15-Yl]carbamate; SCHEMBL613180; SCHEMBL613181; BDBM50269206; 9FD
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Structure |
Download2D MOL |
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Formula |
C29H30ClN9O4
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Canonical SMILES |
CC1CCCC(C2=NC=C(N2)C3=C(C=C(C=C3)NC(=O)OC)NC(=O)C1)NC(=O)C=CC4=C(C=CC(=C4)Cl)N5C=NN=N5
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InChI |
1S/C29H30ClN9O4/c1-17-4-3-5-22(34-26(40)11-6-18-13-19(30)7-10-25(18)39-16-32-37-38-39)28-31-15-24(36-28)21-9-8-20(33-29(42)43-2)14-23(21)35-27(41)12-17/h6-11,13-17,22H,3-5,12H2,1-2H3,(H,31,36)(H,33,42)(H,34,40)(H,35,41)/b11-6+/t17-,22-/m0/s1
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InChIKey |
GTMMYYLRFTWUSN-GQTIVUJGSA-N
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PubChem Compound ID |
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