Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L3A5DI
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| Ligand Name |
methyl [(5E,8S)-8-[(6R)-6-(3-chlorophenyl)-2-oxo-1,3-oxazinan-3-yl]-2-oxo-1,3,4,7,8,10-hexahydro-2H-12,9-(azeno)-1,10-benzodiazacyclotetradecin-15-yl]carbamate
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| Synonyms |
CHEMBL4515523; methyl [(5E,8S)-8-[(6R)-6-(3-chlorophenyl)-2-oxo-1,3-oxazinan-3-yl]-2-oxo-1,3,4,7,8,10-hexahydro-2H-12,9-(azeno)-1,10-benzodiazacyclotetradecin-15-yl]carbamate; SCHEMBL14700864; BDBM50525764; NRJ
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| Structure |
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Download2D MOL |
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| Formula |
C28H28ClN5O5
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| Canonical SMILES |
COC(=O)NC1=CC2=C(C=C1)C3=CN=C(N3)C(CC=CCCC(=O)N2)N4CCC(OC4=O)C5=CC(=CC=C5)Cl
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| InChI |
1S/C28H28ClN5O5/c1-38-27(36)31-19-10-11-20-21(15-19)32-25(35)9-4-2-3-8-23(26-30-16-22(20)33-26)34-13-12-24(39-28(34)37)17-6-5-7-18(29)14-17/h2-3,5-7,10-11,14-16,23-24H,4,8-9,12-13H2,1H3,(H,30,33)(H,31,36)(H,32,35)/b3-2+/t23-,24+/m0/s1
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| InChIKey |
ZRELHZVMHRERCT-KXHVVKIWSA-N
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| PubChem Compound ID | ||||
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