(E)-4-[6-(hydroxymethyl)-5-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]oxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[6-(hydroxymethyl)-5-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]oxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[3,4-dihydroxy-6-(hydroxymethyl)-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-[3,4-dihydroxy-6-methylol-5-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-tetrahydropyran-2-yl]oxy-4-keto-but-2-enoic acid Formula: C16H24O14 MolecularWeight: 440.35336

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Descriptors Computed from Structure

Canonical SMILES:

C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC(=O)C=CC(=O)O)CO)O)O)O)O

Isomeric SMILES

C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC(=O)/C=C/C(=O)O)CO)O)O)O)O

InChI

InChI=1S/C16H24O14/c17-3-5-9(22)10(23)12(25)16(27-5)30-14-6(4-18)28-15(13(26)11(14)24)29-8(21)2-1-7(19)20/h1-2,5-6,9-18,22-26H,3-4H2,(H,19,20)/b2-1+