Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LJI3V9
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| Ligand Name |
(1S,2S)-2-[[(2S)-2-[[(1S)-1-(4,4-difluorocyclohexyl)ethoxy]carbonylamino]-4-methylpentanoyl]amino]-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid
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| Structure |
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Download2D MOL |
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| Formula |
C22H37F2N3O8S
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| Canonical SMILES |
CC(C)CC(C(=O)NC(CC1CCNC1=O)C(O)S(=O)(=O)O)NC(=O)OC(C)C2CCC(CC2)(F)F
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| InChI |
1S/C22H37F2N3O8S/c1-12(2)10-16(27-21(31)35-13(3)14-4-7-22(23,24)8-5-14)19(29)26-17(20(30)36(32,33)34)11-15-6-9-25-18(15)28/h12-17,20,30H,4-11H2,1-3H3,(H,25,28)(H,26,29)(H,27,31)(H,32,33,34)/t13-,15-,16-,17-,20-/m0/s1
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| InChIKey |
YRNJEPAFOLVHMN-ZZKADIETSA-N
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| PubChem Compound ID | ||||
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