(3S)-4-[2,6-dimethoxy-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]-3-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-4-[2,6-dimethoxy-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]-3-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-hydroxy-4-[4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]-2,6-dimethoxy-phenoxy]-4-oxo-butanoic acid CAS Name: (3S)-3-hydroxy-4-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenoxy]-4-oxobutanoic acid IUPAC Name: (3S)-3-hydroxy-4-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2,6-dimethoxyphenoxy]-4-oxobutanoic acid Traditional Name: (3S)-3-hydroxy-4-[4-[(E)-3-hydroxy-3-keto-prop-1-enyl]-2,6-dimethoxy-phenoxy]-4-keto-butyric acid Formula: C15H16O9 MolecularWeight: 340.28214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC(=O)C(CC(=O)O)O)OC)C=CC(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC(=O)[C@H](CC(=O)O)O)OC)/C=C/C(=O)O

InChI

InChI=1S/C15H16O9/c1-22-10-5-8(3-4-12(17)18)6-11(23-2)14(10)24-15(21)9(16)7-13(19)20/h3-6,9,16H,7H2,1-2H3,(H,17,18)(H,19,20)/b4-3+/t9-/m0/s1