Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LM4RK3
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Ligand Name |
N,N-[2,5-O-DI-3-Fluoro-benzyl-glucaryl]-DI-[1-amino-indan-2-OL]
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Synonyms |
N,N-[2,5-O-DI-3-FLUORO-BENZYL-GLUCARYL]-DI-[1-AMINO-INDAN-2-OL]; 1w5v; SCHEMBL5967838; 1-Valine Methylamide deriv. 13; Q27458352; (2R,3R,4R,5R)-2,5-Bis(3-fluorobenzyloxy)-3,4-dihydroxy-N,N'-bis[(1S,2R)-2-hydroxy-1-indanyl]hexanediamide; (2R,3R,4R,5R)-2,5-bis[(3-fluorophenyl)methoxy]-3,4-dihydroxy-N,N'-bis[(1S,2R)-2-hydroxyindan-1-yl]hexanediamide; N1,N6-Bis-[(2R)-hydroxy-1(S)-indanyl]-(2R,3R,4R,5R)-2,5-bis-(3-fluorobenzyloxy)-3,4-dihydroxyhexanediamide
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Structure |
Download2D MOL |
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Formula |
C38H38F2N2O8
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Canonical SMILES |
C1C(C(C2=CC=CC=C21)NC(=O)C(C(C(C(C(=O)NC3C(CC4=CC=CC=C34)O)OCC5=CC(=CC=C5)F)O)O)OCC6=CC(=CC=C6)F)O
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InChI |
1S/C38H38F2N2O8/c39-25-11-5-7-21(15-25)19-49-35(37(47)41-31-27-13-3-1-9-23(27)17-29(31)43)33(45)34(46)36(50-20-22-8-6-12-26(40)16-22)38(48)42-32-28-14-4-2-10-24(28)18-30(32)44/h1-16,29-36,43-46H,17-20H2,(H,41,47)(H,42,48)/t29-,30-,31+,32+,33-,34-,35-,36-/m1/s1
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InChIKey |
FSNSRNCFARXZOP-JQFCFGFHSA-N
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PubChem Compound ID |
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