Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L21NXQ
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| Ligand Name |
Otilonium
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| Synonyms |
OTILONIUM; Octylonium; 105360-89-2; Otilonium ion; Otilonium cation; 6330179ARU; N,N-Diethyl-N-methyl-2-(4-(2-(octyloxy)benzamido)benzoyloxy)ethanaminium; Ethanaminium, N,N-diethyl-N-methyl-2-((4-((2-(octyloxy)benzoyl)amino)benzoyl)oxy)-; 2-[diethyl(methyl)-$l^{4}-azanyl]ethyl 4-[(2-octoxyphenyl)carbonylamino]benzoate; NCGC00163507-01; UNII-6330179ARU; Diethyl-methyl-[2-[4-[(2-octoxybenzoyl)amino]benzoyl]oxyethyl]azanium; OTILONIUM [WHO-DD]; CHEMBL1433361; DTXSID0048391; SCHEMBL20352274; CHEBI:135780; ZINC8214636; DB13500; NCGC00163507-02; AB01566869_01; Q27263551; 7TB
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| Structure |
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Download2D MOL
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| Formula |
C29H43N2O4+
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| Canonical SMILES |
CCCCCCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)OCC[N+](C)(CC)CC
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| InChI |
1S/C29H42N2O4/c1-5-8-9-10-11-14-22-34-27-16-13-12-15-26(27)28(32)30-25-19-17-24(18-20-25)29(33)35-23-21-31(4,6-2)7-3/h12-13,15-20H,5-11,14,21-23H2,1-4H3/p+1
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| InChIKey |
NQHNLNLJPDMBFN-UHFFFAOYSA-O
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| PubChem Compound ID | ||||
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