Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LLUX92
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Ligand Name |
ethyl (4R)-5-[(3S)-2-oxopyrrolidin-3-yl]-4-[[(2S)-3-phenyl-2-[[(2R)-3-phenyl-2-(3-prop-2-ynoxypropanoylamino)propanoyl]amino]propanoyl]amino]pentanoate
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Structure |
Download2D MOL
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Formula |
C35H44N4O7
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Canonical SMILES |
CCOC(=O)CCC(CC1CCNC1=O)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC3=CC=CC=C3)NC(=O)CCOCC#C
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InChI |
1S/C35H44N4O7/c1-3-20-45-21-18-31(40)38-29(22-25-11-7-5-8-12-25)35(44)39-30(23-26-13-9-6-10-14-26)34(43)37-28(15-16-32(41)46-4-2)24-27-17-19-36-33(27)42/h1,5-14,27-30H,4,15-24H2,2H3,(H,36,42)(H,37,43)(H,38,40)(H,39,44)/t27-,28+,29+,30-/m0/s1
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InChIKey |
DFVBMNVNJFHZTI-KJHMZRPRSA-N
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PubChem Compound ID |
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