[(3S)-5-acetamido-2-(hydroxymethyl)-4-oxidanyl-6-phenylmethoxy-oxan-3-yl] methanesulfonate

Systemtic Name: [(3S)-5-acetamido-2-(hydroxymethyl)-4-oxidanyl-6-phenylmethoxy-oxan-3-yl] methanesulfonate Openeye Name: [(3S)-5-acetamido-6-benzyloxy-4-hydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl] methanesulfonate CAS Name: methanesulfonic acid [(3S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(3S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-phenylmethoxyoxan-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(3S)-5-acetamido-6-benzoxy-4-hydroxy-2-methylol-tetrahydropyran-3-yl] ester Formula: C16H23NO8S MolecularWeight: 389.42072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OCC2=CC=CC=C2)CO)OS(=O)(=O)C)O

Isomeric SMILES

CC(=O)NC1C([C@@H](C(OC1OCC2=CC=CC=C2)CO)OS(=O)(=O)C)O

InChI

InChI=1S/C16H23NO8S/c1-10(19)17-13-14(20)15(25-26(2,21)22)12(8-18)24-16(13)23-9-11-6-4-3-5-7-11/h3-7,12-16,18,20H,8-9H2,1-2H3,(H,17,19)/t12?,13?,14?,15-,16?/m1/s1