Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L32JYE
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| Ligand Name |
Fatty acids, C6-12, mixed esters with C18-unsatd. fatty acid dimers and dipentaerythritol and isononanoic acid
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| Synonyms |
CHEMBL4071740; 11-[(3-Hydroxyphenyl)methyl]-18-Methoxy-2,17-Dimethyl-14-(Propan-2-Yl)-3-Oxa-9,12,15,28-Tetraazatricyclo[21.3.1.1~5,9~]octacosa-1(27),21,23,25-Tetraene-4,10,13,16-Tetrone; SCHEMBL9946448; SCHEMBL14634949; BDBM50230294; 146832-04-4; (E)-(2R,5S,11S,14S,17R,18R)-11-(3-hydroxy-benzyl)-14-isopropyl-18-methoxy-2,17-dimethyl-3-oxa-9,12,15,28-tetraaza-tricyclo[21.3.1.1*5,9*]octacosa-1(27),21,23,25-tetraene-4,10,13,16-tetraone; 78X
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| Structure |
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Download2D MOL |
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| Formula |
C36H48N4O7
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| Canonical SMILES |
CC1C(CCC=CC2=CC(=CC=C2)C(OC(=O)C3CCCN(N3)C(=O)C(NC(=O)C(NC1=O)C(C)C)CC4=CC(=CC=C4)O)C)OC
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| InChI |
1S/C36H48N4O7/c1-22(2)32-34(43)37-30(21-26-13-9-15-28(41)20-26)35(44)40-18-10-16-29(39-40)36(45)47-24(4)27-14-8-12-25(19-27)11-6-7-17-31(46-5)23(3)33(42)38-32/h6,8-9,11-15,19-20,22-24,29-32,39,41H,7,10,16-18,21H2,1-5H3,(H,37,43)(H,38,42)/b11-6+/t23-,24-,29+,30+,31-,32+/m1/s1
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| InChIKey |
SDVRVWXKFPHKSR-IBVKFTFISA-N
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| PubChem Compound ID | ||||
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