Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LCA9Z8
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| Ligand Name |
N-{2-[trans-7-Chloro-1-(2,2-dimethyl-propyl)-5-naphthalen-1-YL-2-oxo-1,2,3,5-tetrahydro-benzo[E] [1,4]oxazepin-3-YL]-acetyl}-aspartic acid
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| Synonyms |
cp-320473; N-{2-[TRANS-7-CHLORO-1-(2,2-DIMETHYL-PROPYL) -5-NAPHTHALEN-1-YL-2-OXO-1,2,3,5-TETRAHYDRO-BENZO[E] [1,4]OXAZEPIN-3-YL]-ACETYL}-ASPARTIC ACID; 1ezf; IN0; [1,4]OXAZEPIN-3-YL]-ACETYL}-ASPARTIC ACID; Q27461472
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| Structure |
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Download2D MOL |
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| Formula |
C30H31ClN2O7
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| Canonical SMILES |
CC(C)(C)CN1C2=C(C=C(C=C2)Cl)C(OC(C1=O)CC(=O)NC(CC(=O)O)C(=O)O)C3=CC=CC4=CC=CC=C43
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| InChI |
1S/C30H31ClN2O7/c1-30(2,3)16-33-23-12-11-18(31)13-21(23)27(20-10-6-8-17-7-4-5-9-19(17)20)40-24(28(33)37)15-25(34)32-22(29(38)39)14-26(35)36/h4-13,22,24,27H,14-16H2,1-3H3,(H,32,34)(H,35,36)(H,38,39)/t22-,24+,27+/m0/s1
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| InChIKey |
GXDQAFKUUPODFF-CAKYRVLISA-N
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| PubChem Compound ID | ||||
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