[2-(2-hexadecanoyloxy-1-oxidanyl-ethyl)-4-oxidanyl-5-oxidanylidene-2H-furan-3-yl] 3,4,5-tris(oxidanyl)benzoate

Systemtic Name: [2-(2-hexadecanoyloxy-1-oxidanyl-ethyl)-4-oxidanyl-5-oxidanylidene-2H-furan-3-yl] 3,4,5-tris(oxidanyl)benzoate Openeye Name: [2-(2-hexadecanoyloxy-1-hydroxy-ethyl)-4-hydroxy-5-oxo-2H-furan-3-yl] 3,4,5-trihydroxybenzoate CAS Name: 3,4,5-trihydroxybenzoic acid [4-hydroxy-2-[1-hydroxy-2-(1-oxohexadecoxy)ethyl]-5-oxo-2H-furan-3-yl] ester IUPAC Name: [2-(2-hexadecanoyloxy-1-hydroxyethyl)-4-hydroxy-5-oxo-2H-furan-3-yl] 3,4,5-trihydroxybenzoate Traditional Name: 3,4,5-trihydroxybenzoic acid [2-(2-hexadecanoyloxy-1-hydroxy-ethyl)-4-hydroxy-5-keto-2H-furan-3-yl] ester Formula: C29H42O11 MolecularWeight: 566.63718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(C1C(=C(C(=O)O1)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(C1C(=C(C(=O)O1)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)O

InChI

InChI=1S/C29H42O11/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23(33)38-18-22(32)26-27(25(35)29(37)39-26)40-28(36)19-16-20(30)24(34)21(31)17-19/h16-17,22,26,30-32,34-35H,2-15,18H2,1H3