Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LJB9T1
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| Ligand Name |
(1R,2S,5S)-N-[(1S,2S)-1-(1,3-benzothiazol-2-yl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-(4-methoxy-1H-indole-2-carbonyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
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| Structure |
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Download2D MOL |
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| Formula |
C32H35N5O5S
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| Canonical SMILES |
CC1(C2C1C(N(C2)C(=O)C3=CC4=C(N3)C=CC=C4OC)C(=O)NC(CC5CCNC5=O)C(C6=NC7=CC=CC=C7S6)O)C
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| InChI |
1S/C32H35N5O5S/c1-32(2)18-15-37(31(41)22-14-17-19(34-22)8-6-9-23(17)42-3)26(25(18)32)29(40)35-21(13-16-11-12-33-28(16)39)27(38)30-36-20-7-4-5-10-24(20)43-30/h4-10,14,16,18,21,25-27,34,38H,11-13,15H2,1-3H3,(H,33,39)(H,35,40)/t16-,18-,21-,25-,26-,27-/m0/s1
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| InChIKey |
CVWZBMVWUPHSSU-AJEOIHGXSA-N
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| PubChem Compound ID | ||||
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