5-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-5-oxo-pentanoic acid CAS Name: 5-oxo-5-[3-[(E)-1-oxoheptadec-8-enoxy]-2-[(E)-1-oxononadec-10-enoxy]propoxy]pentanoic acid IUPAC Name: 5-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxypropoxy]-5-oxopentanoic acid Traditional Name: 5-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-5-keto-valeric acid Formula: C44H78O8 MolecularWeight: 735.08532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC(=O)OC(COC(=O)CCCCCCC=CCCCCCCCC)COC(=O)CCCC(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC(=O)OC(COC(=O)CCCCCC/C=C/CCCCCCCC)COC(=O)CCCC(=O)O

InChI

InChI=1S/C44H78O8/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-36-44(49)52-40(39-51-43(48)37-33-34-41(45)46)38-50-42(47)35-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h17-19,21,40H,3-16,20,22-39H2,1-2H3,(H,45,46)/b19-17+,21-18+