Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LJXH38
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| Ligand Name |
(2S,4S)-N-[(3R,5R)-1-cyclopropylcarbonyl-5-[[[4-[2-[4-[(1S)-2-methoxy-1-oxidanyl-ethyl]phenyl]ethynyl]phenyl]carbonylamino]methyl]pyrrolidin-3-yl]-4-fluoranyl-pyrrolidine-2-carboxamide
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| Synonyms |
(2S,4S)-N-[(3R,5R)-1-cyclopropylcarbonyl-5-[[[4-[2-[4-[(1S)-2-methoxy-1-oxidanyl-ethyl]phenyl]ethynyl]phenyl]carbonylamino]methyl]pyrrolidin-3-yl]-4-fluoranyl-pyrrolidine-2-carboxamide; 9DO
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| Structure |
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Download2D MOL |
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| Formula |
C32H37FN4O5
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| Canonical SMILES |
COCC(C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)NCC3CC(CN3C(=O)C4CC4)NC(=O)C5CC(CN5)F)O
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| InChI |
1S/C32H37FN4O5/c1-42-19-29(38)22-8-4-20(5-9-22)2-3-21-6-10-23(11-7-21)30(39)35-17-27-15-26(18-37(27)32(41)24-12-13-24)36-31(40)28-14-25(33)16-34-28/h4-11,24-29,34,38H,12-19H2,1H3,(H,35,39)(H,36,40)/t25-,26+,27+,28-,29+/m0/s1
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| InChIKey |
IKKZQZOORIUDON-MLZSXWJDSA-N
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| PubChem Compound ID | ||||
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