Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L7WBH5
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| Ligand Name |
1,3-Bis(4-(tert-butoxycarbonyl)benzamido)-2,4-bis(3-methoxy-4-(thiophene-2-carbonyloxy)phenyl)cyclobutane-1,3-dicarboxylic acid
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| Synonyms |
Boc5; CHEMBL449327; 917569-14-3; CHEMBL2158411; 1,3-Bis[[4-(tert-butoxy-carbonylamino)benzoyl]amino]-2,4-bis[3-methoxy-4-(thiophene-2-carbonyloxy)-phenyl]cyclobutane-1,3-dicarboxylic acid; 2,4-bis(3-methoxy-4-thiophen-2-ylcarbonyloxy-phenyl)-1,3-bis[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbonylamino]cyclobutane-1,3-dicarboxylic acid; CHEMBL2158412; CHEMBL2158413; CHEMBL2158414; SCHEMBL12216463; BDBM50260246; BDBM50519372; AC-31469; 1,3-bis(4-(tert-butoxycarbonyl)benzamido)-2,4-bis(3-methoxy-4-(thiophene-2-carbonyloxy)phenyl)cyclobutane-1,3-dicarboxylic acid; 1,3-Bis[4-(tert-butyloxycarbonylamino)benzoylamino]-2,4-bis[3-methoxy-4-[(2-thienyl)carbonyloxy]phenyl]cyclobutane-1,3-dicarboxylic acid; 2,4-Bis[3-methoxy-4-(thiophene-2-carbonyloxy)phenyl]-1,3-bis[[4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoyl]amino]cyclobutane-1,3-dicarboxylic acid; BYI
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| Structure |
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Download2D MOL
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| Formula |
C54H52N4O16S2
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| Canonical SMILES |
CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC2(C(C(C2C3=CC(=C(C=C3)OC(=O)C4=CC=CS4)OC)(C(=O)O)NC(=O)C5=CC=C(C=C5)NC(=O)OC(C)(C)C)C6=CC(=C(C=C6)OC(=O)C7=CC=CS7)OC)C(=O)O
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| InChI |
1S/C54H52N4O16S2/c1-51(2,3)73-49(67)55-33-19-13-29(14-20-33)43(59)57-53(47(63)64)41(31-17-23-35(37(27-31)69-7)71-45(61)39-11-9-25-75-39)54(48(65)66,58-44(60)30-15-21-34(22-16-30)56-50(68)74-52(4,5)6)42(53)32-18-24-36(38(28-32)70-8)72-46(62)40-12-10-26-76-40/h9-28,41-42H,1-8H3,(H,55,67)(H,56,68)(H,57,59)(H,58,60)(H,63,64)(H,65,66)
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| InChIKey |
JSLFGFBQFKCNSQ-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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