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

Systemtic Name: tetrasodium 3-methoxy-6-[6-methoxy-4-oxidanyl-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-4-oxidanyl-5-sulfonatooxy-oxane-2-carboxylate Openeye Name: tetrasodium 4-hydroxy-6-[4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)tetrahydropyran-3-yl]oxy-3-methoxy-5-sulfonatooxy-tetrahydropyran-2-carboxylate CAS Name: tetrasodium 4-hydroxy-6-[[4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)-3-oxanyl]oxy]-3-methoxy-5-sulfonatooxy-2-oxanecarboxylate IUPAC Name: tetrasodium 4-hydroxy-6-[4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-3-methoxy-5-sulfonatooxyoxane-2-carboxylate Traditional Name: tetrasodium 4-hydroxy-6-[4-hydroxy-6-methoxy-2-(sulfatomethyl)-5-(sulfonatoamino)tetrahydropyran-3-yl]oxy-3-methoxy-5-sulfato-tetrahydropyran-2-carboxylate Formula: C14H21NNa4O20S3 MolecularWeight: 711.46532

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(OC1C(=O)[O-])OC2C(OC(C(C2O)NS(=O)(=O)[O-])OC)COS(=O)(=O)[O-])OS(=O)(=O)[O-])O.[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

COC1C(C(C(OC1C(=O)[O-])OC2C(OC(C(C2O)NS(=O)(=O)[O-])OC)COS(=O)(=O)[O-])OS(=O)(=O)[O-])O.[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C14H25NO20S3.4Na/c1-29-9-7(17)10(35-38(26,27)28)14(34-11(9)12(18)19)33-8-4(3-31-37(23,24)25)32-13(30-2)5(6(8)16)15-36(20,21)22;;;;/h4-11,13-17H,3H2,1-2H3,(H,18,19)(H,20,21,22)(H,23,24,25)(H,26,27,28);;;;/q;4*+1/p-4