methyl (E,10R,13S)-10,13-bis(oxidanyl)octadec-11-enoate

Systemtic Name: methyl (E,10R,13S)-10,13-bis(oxidanyl)octadec-11-enoate Openeye Name: methyl (E,10R,13S)-10,13-dihydroxyoctadec-11-enoate CAS Name: (E,10R,13S)-10,13-dihydroxy-11-octadecenoic acid methyl ester IUPAC Name: methyl (E,10R,13S)-10,13-dihydroxyoctadec-11-enoate Traditional Name: (E,10R,13S)-10,13-dihydroxyoctadec-11-enoic acid methyl ester Formula: C19H36O4 MolecularWeight: 328.48674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC(CCCCCCCCC(=O)OC)O)O

Isomeric SMILES

CCCCC[C@@H](/C=C/[C@@H](CCCCCCCCC(=O)OC)O)O

InChI

InChI=1S/C19H36O4/c1-3-4-9-12-17(20)15-16-18(21)13-10-7-5-6-8-11-14-19(22)23-2/h15-18,20-21H,3-14H2,1-2H3/b16-15+/t17-,18+/m0/s1