KT0
5'-O-[(2-hydroxybenzoyl)sulfamoyl]adenosine
Find entries where: KT0
is present as a standalone ligand in 2 entries
Chemical Component Summary | |
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Name | 5'-O-[(2-hydroxybenzoyl)sulfamoyl]adenosine |
Identifiers | [(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-(2-hydroxyphenyl)carbonylsulfamate |
Formula | C17 H18 N6 O8 S |
Molecular Weight | 466.425 |
Type | NON-POLYMER |
Isomeric SMILES | c1ccc(c(c1)C(=O)NS(=O)(=O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)n3cnc4c3ncnc4N)O)O)O |
InChI | InChI=1S/C17H18N6O8S/c18-14-11-15(20-6-19-14)23(7-21-11)17-13(26)12(25)10(31-17)5-30-32(28,29)22-16(27)8-3-1-2-4-9(8)24/h1-4,6-7,10,12-13,17,24-26H,5H2,(H,22,27)(H2,18,19,20)/t10-,12-,13-,17-/m1/s1 |
InChIKey | SABYITLYKSVAAD-CNEMSGBDSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 50 |
Chiral Atom Count | 4 |
Bond Count | 53 |
Aromatic Bond Count | 16 |
Related Resource References
Resource Name | Reference |
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PubChem | 636430 |
ChEMBL | CHEMBL371502 |