[5-[(E)-octadec-10-enoyl]oxy-4-oxidanylidene-pyran-2-yl]methyl (E)-octadec-9-enoate

Systemtic Name: [5-[(E)-octadec-10-enoyl]oxy-4-oxidanylidene-pyran-2-yl]methyl (E)-octadec-9-enoate Openeye Name: [5-[(E)-octadec-10-enoyl]oxy-4-oxo-pyran-2-yl]methyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [4-oxo-5-[(E)-1-oxooctadec-10-enoxy]-2-pyranyl]methyl ester IUPAC Name: [5-[(E)-octadec-10-enoyl]oxy-4-oxopyran-2-yl]methyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [4-keto-5-[(E)-octadec-10-enoyl]oxy-pyran-2-yl]methyl ester Formula: C42H70O6 MolecularWeight: 671.0016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC1=CC(=O)C(=CO1)OC(=O)CCCCCCCCC=CCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCC1=CC(=O)C(=CO1)OC(=O)CCCCCCCC/C=C/CCCCCCC

InChI

InChI=1S/C42H70O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(44)47-36-38-35-39(43)40(37-46-38)48-42(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h16-19,35,37H,3-15,20-34,36H2,1-2H3/b18-16+,19-17+