Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L6P5ON
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| Ligand Name |
2-(4-{2-Tert-butoxycarbonylamino-2-[4-(3-hydroxy-2-methoxycarbonyl-phenoxy)-butylcarbamoyl]-ethyl}-phenoxy)-malonic acid
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| Synonyms |
CHEMBL557758; 2-(4-{2-TERT-BUTOXYCARBONYLAMINO-2-[4-(3-HYDROXY-2-METHOXYCARBONYL-PHENOXY)-BUTYLCARBAMOYL]-ETHYL}-PHENOXY)-MALONIC ACID; 1pyn; BDBM50414103; Q27456959
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| Structure |
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Download2D MOL
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| Formula |
C29H36N2O12
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| Canonical SMILES |
CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OC(C(=O)O)C(=O)O)C(=O)NCCCCOC2=CC=CC(=C2C(=O)OC)O
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| InChI |
1S/C29H36N2O12/c1-29(2,3)43-28(39)31-19(16-17-10-12-18(13-11-17)42-23(25(34)35)26(36)37)24(33)30-14-5-6-15-41-21-9-7-8-20(32)22(21)27(38)40-4/h7-13,19,23,32H,5-6,14-16H2,1-4H3,(H,30,33)(H,31,39)(H,34,35)(H,36,37)/t19-/m0/s1
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| InChIKey |
GFLFMVSYYFLPFQ-IBGZPJMESA-N
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| PubChem Compound ID | ||||
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