(E)-2-[2,3-bis(oxidanyl)propanoyl]octadec-9-enoic acid

Systemtic Name: (E)-2-[2,3-bis(oxidanyl)propanoyl]octadec-9-enoic acid Openeye Name: (E)-2-(2,3-dihydroxypropanoyl)octadec-9-enoic acid CAS Name: (E)-2-(2,3-dihydroxy-1-oxopropyl)-9-octadecenoic acid IUPAC Name: (E)-2-(2,3-dihydroxypropanoyl)octadec-9-enoic acid Traditional Name: (E)-2-glyceroyloctadec-9-enoic acid Formula: C21H38O5 MolecularWeight: 370.52342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(C(=O)C(CO)O)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCC(C(=O)C(CO)O)C(=O)O

InChI

InChI=1S/C21H38O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(21(25)26)20(24)19(23)17-22/h9-10,18-19,22-23H,2-8,11-17H2,1H3,(H,25,26)/b10-9+