Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LD7SC1
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Ligand Name |
(3S)-1-{[(3,5-Dimethylisoxazol-4-YL)amino]carbonyl}-4,4-dimethylpyrrolidin-3-YL{(1S)-1-[1-hydroxy-2-oxo-2-{[(1R)-1-phenylethyl]amino}ethyl]pentyl}carbamate
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Synonyms |
(3S)-1-{[(3,5-DIMETHYLISOXAZOL-4-YL)AMINO]CARBONYL}-4,4-DIMETHYLPYRROLIDIN-3-YL{(1S)-1-[1-HYDROXY-2-OXO-2-{[(1R)-1-PHENYLETHYL]AMINO}ETHYL]PENTYL}CARBAMATE; 2bdl; Q27454878
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Structure |
Download2D MOL |
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Formula |
C28H41N5O6
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Canonical SMILES |
CCCCC(C(C(=O)NC(C)C1=CC=CC=C1)O)NC(=O)OC2CN(CC2(C)C)C(=O)NC3=C(ON=C3C)C
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InChI |
1S/C28H41N5O6/c1-7-8-14-21(24(34)25(35)29-17(2)20-12-10-9-11-13-20)30-27(37)38-22-15-33(16-28(22,5)6)26(36)31-23-18(3)32-39-19(23)4/h9-13,17,21-22,24,34H,7-8,14-16H2,1-6H3,(H,29,35)(H,30,37)(H,31,36)/t17-,21+,22-,24+/m1/s1
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InChIKey |
VVZICJQTDYOKIN-TYVKFHQSSA-N
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PubChem Compound ID |
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