[5-methoxy-6-methoxycarbonyl-2-[6-methoxy-4-oxidanyl-2-(sulfinatoperoxymethyl)-5-(sulfonatoamino)oxan-3-yl]oxy-4-oxidanyl-oxan-3-yl] sulfate

Systemtic Name: [5-methoxy-6-methoxycarbonyl-2-[6-methoxy-4-oxidanyl-2-(sulfinatoperoxymethyl)-5-(sulfonatoamino)oxan-3-yl]oxy-4-oxidanyl-oxan-3-yl] sulfate Openeye Name: [4-hydroxy-2-[4-hydroxy-6-methoxy-2-(sulfinatoperoxymethyl)-5-(sulfonatoamino)tetrahydropyran-3-yl]oxy-5-methoxy-6-methoxycarbonyl-tetrahydropyran-3-yl] sulfate CAS Name: [4-hydroxy-2-[[4-hydroxy-6-methoxy-2-(sulfinatodioxymethyl)-5-(sulfonatoamino)-3-oxanyl]oxy]-5-methoxy-6-methoxycarbonyl-3-oxanyl] sulfate IUPAC Name: [4-hydroxy-2-[4-hydroxy-6-methoxy-2-(sulfinatoperoxymethyl)-5-(sulfonatoamino)oxan-3-yl]oxy-5-methoxy-6-methoxycarbonyloxan-3-yl] sulfate Traditional Name: [6-carbomethoxy-4-hydroxy-2-[4-hydroxy-6-methoxy-2-(sulfinatoperoxymethyl)-5-(sulfonatoamino)tetrahydropyran-3-yl]oxy-5-methoxy-tetrahydropyran-3-yl] sulfate Formula: C15H24NO20S3-3 MolecularWeight: 634.54076

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(OC1C(=O)OC)OC2C(OC(C(C2O)NS(=O)(=O)[O-])OC)COOS(=O)[O-])OS(=O)(=O)[O-])O

Isomeric SMILES

COC1C(C(C(OC1C(=O)OC)OC2C(OC(C(C2O)NS(=O)(=O)[O-])OC)COOS(=O)[O-])OS(=O)(=O)[O-])O

InChI

InChI=1S/C15H27NO20S3/c1-28-10-8(18)11(35-39(25,26)27)15(34-12(10)13(19)29-2)33-9-5(4-31-36-37(20)21)32-14(30-3)6(7(9)17)16-38(22,23)24/h5-12,14-18H,4H2,1-3H3,(H,20,21)(H,22,23,24)(H,25,26,27)/p-3