6-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-6-oxo-hexanoic acid CAS Name: 6-oxo-6-[3-[(E)-1-oxoheptadec-8-enoxy]-2-[(E)-1-oxononadec-10-enoxy]propoxy]hexanoic acid IUPAC Name: 6-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxypropoxy]-6-oxohexanoic acid Traditional Name: 6-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-6-keto-hexanoic acid Formula: C45H80O8 MolecularWeight: 749.1119

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C45H80O8/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-38-45(50)53-41(40-52-44(49)37-34-33-35-42(46)47)39-51-43(48)36-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h17-19,21,41H,3-16,20,22-40H2,1-2H3,(H,46,47)/b19-17+,21-18+