[(3aS,6R,7S,7aR)-6-[2,3-bis(oxidanyl)propyl]-1-methyl-2-oxidanylidene-4,6,7,7a-tetrahydro-3aH-pyrano[4,3-d][1,3]oxazol-7-yl] methanesulfonate

Systemtic Name: [(3aS,6R,7S,7aR)-6-[2,3-bis(oxidanyl)propyl]-1-methyl-2-oxidanylidene-4,6,7,7a-tetrahydro-3aH-pyrano[4,3-d][1,3]oxazol-7-yl] methanesulfonate Openeye Name: [(3aS,6R,7S,7aR)-6-(2,3-dihydroxypropyl)-1-methyl-2-oxo-4,6,7,7a-tetrahydro-3aH-pyrano[4,3-d]oxazol-7-yl] methanesulfonate CAS Name: methanesulfonic acid [(3aS,6R,7S,7aR)-6-(2,3-dihydroxypropyl)-1-methyl-2-oxo-4,6,7,7a-tetrahydro-3aH-pyrano[4,3-d]oxazol-7-yl] ester IUPAC Name: [(3aS,6R,7S,7aR)-6-(2,3-dihydroxypropyl)-1-methyl-2-oxo-4,6,7,7a-tetrahydro-3aH-pyrano[4,3-d][1,3]oxazol-7-yl] methanesulfonate Traditional Name: methanesulfonic acid [(3aS,6R,7S,7aR)-6-glyceryl-2-keto-1-methyl-4,6,7,7a-tetrahydro-3aH-pyrano[4,3-d]oxazol-7-yl] ester Formula: C11H19NO8S MolecularWeight: 325.33546

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2C(COC(C2OS(=O)(=O)C)CC(CO)O)OC1=O

Isomeric SMILES

CN1[C@@H]2[C@@H](CO[C@@H]([C@H]2OS(=O)(=O)C)CC(CO)O)OC1=O

InChI

InChI=1S/C11H19NO8S/c1-12-9-8(19-11(12)15)5-18-7(3-6(14)4-13)10(9)20-21(2,16)17/h6-10,13-14H,3-5H2,1-2H3/t6?,7-,8-,9-,10-/m1/s1