Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1KQ5P
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| Ligand Name |
NC-III-49-1
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| Synonyms |
NC-III-49-1; N,N'-(oxybis{(ethane-2,1-diyl)oxyethane-2,1-diyloxy[3-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-4,1-phenylene]})di(ethane-1-sulfonamide); GLXC-26040; CS-0541761; N,N'-(((((Oxybis(ethane-2,1-diyl))bis(oxy))bis(ethane-2,1-diyl))bis(oxy))bis(3-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-4,1-phenylene))diethanesulfonamide; XR7
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| Structure |
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Download2D MOL
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| Formula |
C44H50N4O11S2
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| Canonical SMILES |
CCS(=O)(=O)NC1=CC(=C(C=C1)OCCOCCOCCOCCOC2=C(C=C(C=C2)NS(=O)(=O)CC)C3=CN(C(=O)C4=CC=CC=C43)C)C5=CN(C(=O)C6=CC=CC=C65)C
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| InChI |
1S/C44H50N4O11S2/c1-5-60(51,52)45-31-15-17-41(37(27-31)39-29-47(3)43(49)35-13-9-7-11-33(35)39)58-25-23-56-21-19-55-20-22-57-24-26-59-42-18-16-32(46-61(53,54)6-2)28-38(42)40-30-48(4)44(50)36-14-10-8-12-34(36)40/h7-18,27-30,45-46H,5-6,19-26H2,1-4H3
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| InChIKey |
VGOFJMULWAVDMV-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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