[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] 5-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: [6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] 5-methyl-1H-pyrrole-2-carboxylate Openeye Name: [3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] 5-methyl-1H-pyrrole-2-carboxylate CAS Name: 5-methyl-1H-pyrrole-2-carboxylic acid [3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl] ester IUPAC Name: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-methyl-1H-pyrrole-2-carboxylic acid (3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl) ester Formula: C12H17NO7 MolecularWeight: 287.26588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1)C(=O)OC2C(C(C(C(O2)CO)O)O)O

Isomeric SMILES

CC1=CC=C(N1)C(=O)OC2C(C(C(C(O2)CO)O)O)O

InChI

InChI=1S/C12H17NO7/c1-5-2-3-6(13-5)11(18)20-12-10(17)9(16)8(15)7(4-14)19-12/h2-3,7-10,12-17H,4H2,1H3