Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L08CLI
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| Ligand Name |
(2s)-2-[(2s,3r)-10-{[(4-Fluorophenyl)sulfonyl]amino}-3-Methyl-2-[(Methyl{[4-(Trifluoromethyl)phenyl]carbamoyl}amino)methyl]-6-Oxo-3,4-Dihydro-2h-1,5-Benzoxazocin-5(6h)-Yl]propanoic Acid
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| Synonyms |
CHEMBL3358892; (2s)-2-[(2s,3r)-10-{[(4-Fluorophenyl)sulfonyl]amino}-3-Methyl-2-[(Methyl{[4-(Trifluoromethyl)phenyl]carbamoyl}amino)methyl]-6-Oxo-3,4-Dihydro-2h-1,5-Benzoxazocin-5(6h)-Yl]propanoic Acid; 4wgi; BDBM50041679; Q27453922; 3M6
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| Structure |
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Download2D MOL |
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| Formula |
C30H30F4N4O7S
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| Canonical SMILES |
CC1CN(C(=O)C2=C(C(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)F)OC1CN(C)C(=O)NC4=CC=C(C=C4)C(F)(F)F)C(C)C(=O)O
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| InChI |
1S/C30H30F4N4O7S/c1-17-15-38(18(2)28(40)41)27(39)23-5-4-6-24(36-46(43,44)22-13-9-20(31)10-14-22)26(23)45-25(17)16-37(3)29(42)35-21-11-7-19(8-12-21)30(32,33)34/h4-14,17-18,25,36H,15-16H2,1-3H3,(H,35,42)(H,40,41)/t17-,18+,25-/m1/s1
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| InChIKey |
XAEPMFMCFFIZDH-FUMQJTLXSA-N
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| PubChem Compound ID | ||||
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