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

Systemtic Name: 3-[3,4-disulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4,5-dimethoxy-oxane-2-carboxylate Openeye Name: 3-[3,4-disulfonatooxy-6-(sulfonatooxymethyl)tetrahydropyran-2-yl]oxy-4,5-dimethoxy-tetrahydropyran-2-carboxylate CAS Name: 3-[[3,4-disulfonatooxy-6-(sulfonatooxymethyl)-2-oxanyl]oxy]-4,5-dimethoxy-2-oxanecarboxylate IUPAC Name: 3-[3,4-disulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4,5-dimethoxyoxane-2-carboxylate Traditional Name: 3-[3,4-disulfato-6-(sulfatomethyl)tetrahydropyran-2-yl]oxy-4,5-dimethoxy-tetrahydropyran-2-carboxylate Formula: C14H20O19S3-4 MolecularWeight: 588.4922

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Descriptors Computed from Structure

Canonical SMILES:

COC1COC(C(C1OC)OC2C(C(CC(O2)COS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1COC(C(C1OC)OC2C(C(CC(O2)COS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H24O19S3/c1-26-8-5-28-12(13(15)16)11(9(8)27-2)31-14-10(33-36(23,24)25)7(32-35(20,21)22)3-6(30-14)4-29-34(17,18)19/h6-12,14H,3-5H2,1-2H3,(H,15,16)(H,17,18,19)(H,20,21,22)(H,23,24,25)/p-4