[4-ethanoyl-5,6,7-tris(oxidanyl)-2,3-bis(oxidanylidene)-8-phenyl-octan-4-yl] ethanoate

Systemtic Name: [4-ethanoyl-5,6,7-tris(oxidanyl)-2,3-bis(oxidanylidene)-8-phenyl-octan-4-yl] ethanoate Openeye Name: [1-acetyl-2,3,4-trihydroxy-1-(2-oxopropanoyl)-5-phenyl-pentyl] acetate CAS Name: acetic acid (4-acetyl-5,6,7-trihydroxy-2,3-dioxo-8-phenyloctan-4-yl) ester IUPAC Name: (4-acetyl-5,6,7-trihydroxy-2,3-dioxo-8-phenyloctan-4-yl) acetate Traditional Name: acetic acid (1-acetyl-2,3,4-trihydroxy-5-phenyl-1-pyruvoyl-pentyl) ester Formula: C18H22O8 MolecularWeight: 366.36248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)C(C(C(C(CC1=CC=CC=C1)O)O)O)(C(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)C(=O)C(C(C(C(CC1=CC=CC=C1)O)O)O)(C(=O)C)OC(=O)C

InChI

InChI=1S/C18H22O8/c1-10(19)16(24)18(11(2)20,26-12(3)21)17(25)15(23)14(22)9-13-7-5-4-6-8-13/h4-8,14-15,17,22-23,25H,9H2,1-3H3