[(2R,3R,4R,5S,6S)-2-methoxy-6-methyl-5-propoxy-3-sulfooxy-oxan-4-yl] hydrogen sulfate

Systemtic Name: [(2R,3R,4R,5S,6S)-2-methoxy-6-methyl-5-propoxy-3-sulfooxy-oxan-4-yl] hydrogen sulfate Openeye Name: [(2R,3R,4R,5S,6S)-2-methoxy-6-methyl-5-propoxy-3-sulfooxy-tetrahydropyran-4-yl] hydrogen sulfate CAS Name: sulfuric acid [(2R,3R,4R,5S,6S)-2-methoxy-6-methyl-5-propoxy-3-sulfooxy-4-oxanyl] ester IUPAC Name: [(2R,3R,4R,5S,6S)-2-methoxy-6-methyl-5-propoxy-3-sulfooxyoxan-4-yl] hydrogen sulfate Traditional Name: sulfuric acid [(2R,3R,4R,5S,6S)-2-methoxy-6-methyl-5-propoxy-3-sulfoxy-tetrahydropyran-4-yl] ester Formula: C10H20O11S2 MolecularWeight: 380.3892

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1C(OC(C(C1OS(=O)(=O)O)OS(=O)(=O)O)OC)C

Isomeric SMILES

CCCO[C@H]1[C@@H](O[C@H]([C@@H]([C@@H]1OS(=O)(=O)O)OS(=O)(=O)O)OC)C

InChI

InChI=1S/C10H20O11S2/c1-4-5-18-7-6(2)19-10(17-3)9(21-23(14,15)16)8(7)20-22(11,12)13/h6-10H,4-5H2,1-3H3,(H,11,12,13)(H,14,15,16)/t6-,7-,8+,9+,10+/m0/s1