Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L5Y0FP
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| Ligand Name |
(2r)-2-[({1-[3-({(2r,3r,4r,5s,6r)-3-(Acetylamino)-4,5-Bis(Acetyloxy)-6-[(Acetyloxy)methyl]tetrahydro-2h-Pyran-2-Yl}oxy)propyl]-1h-1,2,3-Triazol-4-Yl}methyl)(Biphenyl-4-Ylsulfonyl)amino]-3-Methylbutanoic Acid (Non-Preferred Name)
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| Synonyms |
(2r)-2-[({1-[3-({(2r,3r,4r,5s,6r)-3-(Acetylamino)-4,5-Bis(Acetyloxy)-6-[(Acetyloxy)methyl]tetrahydro-2h-Pyran-2-Yl}oxy)propyl]-1h-1,2,3-Triazol-4-Yl}methyl)(Biphenyl-4-Ylsulfonyl)amino]-3-Methylbutanoic Acid (Non-Preferred Name); Q27456249; 67M
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| Structure |
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Download2D MOL
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| Formula |
C37H47N5O13S
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| Canonical SMILES |
CC(C)C(C(=O)O)N(CC1=CN(N=N1)CCCOC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4
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| InChI |
1S/C37H47N5O13S/c1-22(2)33(36(47)48)42(56(49,50)30-15-13-28(14-16-30)27-11-8-7-9-12-27)20-29-19-41(40-39-29)17-10-18-51-37-32(38-23(3)43)35(54-26(6)46)34(53-25(5)45)31(55-37)21-52-24(4)44/h7-9,11-16,19,22,31-35,37H,10,17-18,20-21H2,1-6H3,(H,38,43)(H,47,48)/t31-,32-,33-,34-,35-,37-/m1/s1
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| InChIKey |
GRIPTHDAFNBNAB-HTJFLOPLSA-N
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| PubChem Compound ID | ||||
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