3-[4,5-dimethoxy-3-sulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4-methoxy-5-sulfonatooxy-oxane-2-carboxylate

Systemtic Name: 3-[4,5-dimethoxy-3-sulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4-methoxy-5-sulfonatooxy-oxane-2-carboxylate Openeye Name: 3-[4,5-dimethoxy-3-sulfonatooxy-6-(sulfonatooxymethyl)tetrahydropyran-2-yl]oxy-4-methoxy-5-sulfonatooxy-tetrahydropyran-2-carboxylate CAS Name: 3-[[4,5-dimethoxy-3-sulfonatooxy-6-(sulfonatooxymethyl)-2-oxanyl]oxy]-4-methoxy-5-sulfonatooxy-2-oxanecarboxylate IUPAC Name: 3-[4,5-dimethoxy-3-sulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4-methoxy-5-sulfonatooxyoxane-2-carboxylate Traditional Name: 3-[4,5-dimethoxy-3-sulfato-6-(sulfatomethyl)tetrahydropyran-2-yl]oxy-4-methoxy-5-sulfato-tetrahydropyran-2-carboxylate Formula: C15H22O20S3-4 MolecularWeight: 618.51818

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(COC(C1OC2C(C(C(C(O2)COS(=O)(=O)[O-])OC)OC)OS(=O)(=O)[O-])C(=O)[O-])OS(=O)(=O)[O-]

Isomeric SMILES

COC1C(COC(C1OC2C(C(C(C(O2)COS(=O)(=O)[O-])OC)OC)OS(=O)(=O)[O-])C(=O)[O-])OS(=O)(=O)[O-]

InChI

InChI=1S/C15H26O20S3/c1-27-8-6(5-31-36(18,19)20)32-15(13(10(8)29-3)35-38(24,25)26)33-11-9(28-2)7(34-37(21,22)23)4-30-12(11)14(16)17/h6-13,15H,4-5H2,1-3H3,(H,16,17)(H,18,19,20)(H,21,22,23)(H,24,25,26)/p-4