6-[6-methoxy-4-oxidanyl-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-3,4,5-trimethyl-oxane-2-carboxylate

Systemtic Name: 6-[6-methoxy-4-oxidanyl-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-3,4,5-trimethyl-oxane-2-carboxylate Openeye Name: 6-[4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)tetrahydropyran-3-yl]oxy-3,4,5-trimethyl-tetrahydropyran-2-carboxylate CAS Name: 6-[[4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)-3-oxanyl]oxy]-3,4,5-trimethyl-2-oxanecarboxylate IUPAC Name: 6-[4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-3,4,5-trimethyloxane-2-carboxylate Traditional Name: 6-[4-hydroxy-6-methoxy-2-(sulfatomethyl)-5-(sulfonatoamino)tetrahydropyran-3-yl]oxy-3,4,5-trimethyl-tetrahydropyran-2-carboxylate Formula: C16H26NO14S2-3 MolecularWeight: 520.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(OC(C1C)OC2C(OC(C(C2O)NS(=O)(=O)[O-])OC)COS(=O)(=O)[O-])C(=O)[O-])C

Isomeric SMILES

CC1C(C(OC(C1C)OC2C(OC(C(C2O)NS(=O)(=O)[O-])OC)COS(=O)(=O)[O-])C(=O)[O-])C

InChI

InChI=1S/C16H29NO14S2/c1-6-7(2)12(14(19)20)30-15(8(6)3)31-13-9(5-28-33(24,25)26)29-16(27-4)10(11(13)18)17-32(21,22)23/h6-13,15-18H,5H2,1-4H3,(H,19,20)(H,21,22,23)(H,24,25,26)/p-3