3,4-bis(oxidanyl)-4-[(3E,6E)-tetradeca-3,6-dienoyl]oxy-butanoic acid

Systemtic Name: 3,4-bis(oxidanyl)-4-[(3E,6E)-tetradeca-3,6-dienoyl]oxy-butanoic acid Openeye Name: 3,4-dihydroxy-4-[(3E,6E)-tetradeca-3,6-dienoyl]oxy-butanoic acid CAS Name: 3,4-dihydroxy-4-[(3E,6E)-1-oxotetradeca-3,6-dienoxy]butanoic acid IUPAC Name: 3,4-dihydroxy-4-[(3E,6E)-tetradeca-3,6-dienoyl]oxybutanoic acid Traditional Name: 3,4-dihydroxy-4-[(3E,6E)-tetradeca-3,6-dienoyl]oxy-butyric acid Formula: C18H30O6 MolecularWeight: 342.4272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=CCC=CCC(=O)OC(C(CC(=O)O)O)O

Isomeric SMILES

CCCCCCC/C=C/C/C=C/CC(=O)OC(C(CC(=O)O)O)O

InChI

InChI=1S/C18H30O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(22)24-18(23)15(19)14-16(20)21/h8-9,11-12,15,18-19,23H,2-7,10,13-14H2,1H3,(H,20,21)/b9-8+,12-11+