Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1CO9W
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| Ligand Name |
6-({(1s,5r)-3-[2-(3,4-Dimethoxyphenoxy)ethyl]-2-Oxo-3,9-Diazabicyclo[3.3.1]non-9-Yl}sulfonyl)-1,3-Benzothiazol-2(3h)-One
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| Synonyms |
6-({(1s,5r)-3-[2-(3,4-Dimethoxyphenoxy)ethyl]-2-Oxo-3,9-Diazabicyclo[3.3.1]non-9-Yl}sulfonyl)-1,3-Benzothiazol-2(3h)-One; 4jfl; Q27452188; 1KY
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| Structure |
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Download2D MOL |
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| Formula |
C24H27N3O7S2
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| Canonical SMILES |
COC1=C(C=C(C=C1)OCCN2CC3CCCC(C2=O)N3S(=O)(=O)C4=CC5=C(C=C4)NC(=O)S5)OC
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| InChI |
1S/C24H27N3O7S2/c1-32-20-9-6-16(12-21(20)33-2)34-11-10-26-14-15-4-3-5-19(23(26)28)27(15)36(30,31)17-7-8-18-22(13-17)35-24(29)25-18/h6-9,12-13,15,19H,3-5,10-11,14H2,1-2H3,(H,25,29)/t15-,19+/m1/s1
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| InChIKey |
VTROBZZFTVMDIJ-BEFAXECRSA-N
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| PubChem Compound ID | ||||
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