sucrosofate

chemical compound

Wikidata entity: Q27093014

C₁₂H₂₂O₃₅S₈ (P274)

Quantities

P2067mass981.771

P233 canonical SMILES String C(C1C(C(C(C(O1)OC2(C(C(C(O2)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O ???
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O ???
P2175 medical condition treated ... Q212961 (pancreatic cancer) pancreatic cancer
P279 subclass of ... Q126610531 (SUCRALFATE (without Al and water)) SUCRALFATE (without Al and water)
P2868 subject has role ... Q41602594 (anti-ulcer drug) anti-ulcer drug
External Ids
P231CAS Registry Number57680-56-5
P683ChEBI ID45560
P592ChEMBL IDCHEMBL1235872
P661ChemSpider ID392225
P715DrugBank IDDB01901
P3117DSSTox substance IDDTXSID701351691
P234InChIInChI=1S/C12H22O35S8/c13-48(14,15)37-1-4-6(43-51(22,23)24)8(45-53(28,29)30)9(46-54(31,32)33)11(40-4)42-12(3-39-50(19,20)21)10(47-55(34,35)36)7(44-52(25,26)27)5(41-12)2-38-49(16,17)18/h4-11H,1-3H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1
P235InChIKeyWEPNHBQBLCNOBB-UGDNZRGBSA-N
P486MeSH descriptor IDC053081
P3636PDB ligand IDSCR
P638PDB structure ID3QRC
P638PDB structure ID5BQC
P638PDB structure ID2YD8
P638PDB structure ID3J4P
P638PDB structure ID4UZ6
P638PDB structure ID2V8E
P638PDB structure ID2P39
P638PDB structure ID3Q7G
P638PDB structure ID2V5E
P638PDB structure ID4BQC
P638PDB structure ID1AFC
P638PDB structure ID3LDJ
P638PDB structure ID2UWN
P638PDB structure ID3CU1
P638PDB structure ID2UUS
P638PDB structure ID3PMA
P638PDB structure ID4UZ9
P638PDB structure ID2YGQ
P11199Probes And Drugs IDPD014313
P662PubChem CID444237
P2877SureChEMBL ID145069
P11089UniChem compound ID638214
P652UNIIP7V86EYZ5L

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