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

Systemtic Name: 3-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-3-oxo-propanoic acid CAS Name: 3-oxo-3-[3-[(E)-1-oxoheptadec-8-enoxy]-2-[(E)-1-oxononadec-10-enoxy]propoxy]propanoic acid IUPAC Name: 3-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxypropoxy]-3-oxopropanoic acid Traditional Name: 3-[3-[(E)-heptadec-8-enoyl]oxy-2-[(E)-nonadec-10-enoyl]oxy-propoxy]-3-keto-propionic acid Formula: C42H74O8 MolecularWeight: 707.03216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C42H74O8/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-41(46)50-38(37-49-42(47)35-39(43)44)36-48-40(45)33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h17-19,21,38H,3-16,20,22-37H2,1-2H3,(H,43,44)/b19-17+,21-18+