3-oxidanyl-5-sulfooxy-6-[4-sulfooxy-5-(sulfooxymethyl)-2-(trioxidanylsulfanyloxymethyl)oxolan-3-yl]oxy-4-(trioxidanylsulfanyloxy)oxane-2-carboxylic acid

Systemtic Name: 3-oxidanyl-5-sulfooxy-6-[4-sulfooxy-5-(sulfooxymethyl)-2-(trioxidanylsulfanyloxymethyl)oxolan-3-yl]oxy-4-(trioxidanylsulfanyloxy)oxane-2-carboxylic acid Openeye Name: 3-hydroxy-5-sulfooxy-6-[4-sulfooxy-5-(sulfooxymethyl)-2-(trioxidanylsulfanyloxymethyl)tetrahydrofuran-3-yl]oxy-4-(trioxidanylsulfanyloxy)tetrahydropyran-2-carboxylic acid CAS Name: 3-hydroxy-5-sulfooxy-6-[[4-sulfooxy-5-(sulfooxymethyl)-2-[(trioxidanylthio)oxymethyl]-3-oxolanyl]oxy]-4-(trioxidanylthio)oxy-2-oxanecarboxylic acid IUPAC Name: 3-hydroxy-5-sulfooxy-6-[4-sulfooxy-5-(sulfooxymethyl)-2-(trioxidanylsulfanyloxymethyl)oxolan-3-yl]oxy-4-(trioxidanylsulfanyloxy)oxane-2-carboxylic acid Traditional Name: 3-hydroxy-5-sulfoxy-6-[4-sulfoxy-5-(sulfoxymethyl)-2-[(trioxidanylthio)oxymethyl]tetrahydrofuran-3-yl]oxy-4-(trioxidanylthio)oxy-tetrahydropyran-2-carboxylic acid Formula: C12H20O26S5 MolecularWeight: 740.5966

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Descriptors Computed from Structure

Canonical SMILES:

C(C1C(C(C(O1)COS(=O)(=O)O)OS(=O)(=O)O)OC2C(C(C(C(O2)C(=O)O)O)OSOOO)OS(=O)(=O)O)OSOOO

Isomeric SMILES

C(C1C(C(C(O1)COS(=O)(=O)O)OS(=O)(=O)O)OC2C(C(C(C(O2)C(=O)O)O)OSOOO)OS(=O)(=O)O)OSOOO

InChI

InChI=1S/C12H20O26S5/c13-5-8(32-40-38-36-17)10(34-43(24,25)26)12(31-9(5)11(14)15)30-6-3(1-27-39-37-35-16)29-4(2-28-41(18,19)20)7(6)33-42(21,22)23/h3-10,12-13,16-17H,1-2H2,(H,14,15)(H,18,19,20)(H,21,22,23)(H,24,25,26)