(E)-4-oxidanylidene-4-[3,4,5-tris(oxidanyl)-1-oxidanylidene-pentan-2-yl]oxy-but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[3,4,5-tris(oxidanyl)-1-oxidanylidene-pentan-2-yl]oxy-but-2-enoic acid Openeye Name: (E)-4-(1-formyl-2,3,4-trihydroxy-butoxy)-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-(3,4,5-trihydroxy-1-oxopentan-2-yl)oxy-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(3,4,5-trihydroxy-1-oxopentan-2-yl)oxybut-2-enoic acid Traditional Name: (E)-4-(1-formyl-2,3,4-trihydroxy-butoxy)-4-keto-but-2-enoic acid Formula: C9H12O8 MolecularWeight: 248.18678

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(C(C=O)OC(=O)C=CC(=O)O)O)O)O

Isomeric SMILES

C(C(C(C(C=O)OC(=O)/C=C/C(=O)O)O)O)O

InChI

InChI=1S/C9H12O8/c10-3-5(12)9(16)6(4-11)17-8(15)2-1-7(13)14/h1-2,4-6,9-10,12,16H,3H2,(H,13,14)/b2-1+