[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl] 4-(hydroxymethyl)-2-methyl-furan-3-carboxylate

Systemtic Name: [(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl] 4-(hydroxymethyl)-2-methyl-furan-3-carboxylate Openeye Name: [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl] 4-(hydroxymethyl)-2-methyl-furan-3-carboxylate CAS Name: 4-(hydroxymethyl)-2-methyl-3-furancarboxylic acid [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl] ester IUPAC Name: [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl] 4-(hydroxymethyl)-2-methylfuran-3-carboxylate Traditional Name: 2-methyl-4-methylol-furan-3-carboxylic acid [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl] ester Formula: C13H18O8 MolecularWeight: 302.27722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC(=O)C2=C(OC=C2CO)C)O)O)O

Isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC(=O)C2=C(OC=C2CO)C)O)O)O

InChI

InChI=1S/C13H18O8/c1-5-8(7(3-14)4-19-5)12(18)21-13-11(17)10(16)9(15)6(2)20-13/h4,6,9-11,13-17H,3H2,1-2H3/t6-,9-,10+,11+,13-/m0/s1