Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LD80UP
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| Ligand Name |
tert-butyl N-[(2S)-1-[(2R)-1-oxo-3-phenyl-1-(3-pyridin-3-ylpropylamino)propan-2-yl]sulfanyl-3-phenylpropan-2-yl]carbamate;2,6-dipyridin-2-ylpyridine;2-methyl-6-(6-methylpyridin-2-yl)pyridine;ruthenium
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| Structure |
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Download2D MOL
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| Formula |
C58H62N8O3RuS
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| Canonical SMILES |
CC1=NC(=CC=C1)C2=CC=CC(=N2)C.CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CSC(CC2=CC=CC=C2)C(=O)NCCCC3=CN=CC=C3.C1=CC=NC(=C1)C2=NC(=CC=C2)C3=CC=CC=N3.[Ru]
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| InChI |
1S/C31H39N3O3S.C15H11N3.C12H12N2.Ru/c1-31(2,3)37-30(36)34-27(20-24-12-6-4-7-13-24)23-38-28(21-25-14-8-5-9-15-25)29(35)33-19-11-17-26-16-10-18-32-22-26;1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;/h4-10,12-16,18,22,27-28H,11,17,19-21,23H2,1-3H3,(H,33,35)(H,34,36);1-11H;3-8H,1-2H3;/t27-,28+;;;/m0.../s1
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| InChIKey |
FVGJXMAFINABIT-VKKDUPNPSA-N
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| PubChem Compound ID | ||||
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