(4S,5R)-5-(3,4-dimethoxyphenyl)-4-methyl-2-oxidanylidene-3-(3-oxidanylidenebutyl)oxolane-3-carboxylic acid

Systemtic Name: (4S,5R)-5-(3,4-dimethoxyphenyl)-4-methyl-2-oxidanylidene-3-(3-oxidanylidenebutyl)oxolane-3-carboxylic acid Openeye Name: (4S,5R)-5-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-3-(3-oxobutyl)tetrahydrofuran-3-carboxylic acid CAS Name: (4S,5R)-5-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-3-(3-oxobutyl)-3-oxolanecarboxylic acid IUPAC Name: (4S,5R)-5-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-3-(3-oxobutyl)oxolane-3-carboxylic acid Traditional Name: (4S,5R)-5-(3,4-dimethoxyphenyl)-2-keto-3-(3-ketobutyl)-4-methyl-tetrahydrofuran-3-carboxylic acid Formula: C18H22O7 MolecularWeight: 350.36308

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(=O)C1(CCC(=O)C)C(=O)O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C[C@@H]1[C@@H](OC(=O)C1(CCC(=O)C)C(=O)O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H22O7/c1-10(19)7-8-18(16(20)21)11(2)15(25-17(18)22)12-5-6-13(23-3)14(9-12)24-4/h5-6,9,11,15H,7-8H2,1-4H3,(H,20,21)/t11-,15-,18?/m1/s1