2,3-bis(oxidanyl)propyl (E)-2,2,3-triethanoyl-12-oxidanyl-octadec-9-enoate

Systemtic Name: 2,3-bis(oxidanyl)propyl (E)-2,2,3-triethanoyl-12-oxidanyl-octadec-9-enoate Openeye Name: 2,3-dihydroxypropyl (E)-2,2,3-triacetyl-12-hydroxy-octadec-9-enoate CAS Name: (E)-2,2,3-triacetyl-12-hydroxy-9-octadecenoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl (E)-2,2,3-triacetyl-12-hydroxyoctadec-9-enoate Traditional Name: (E)-2,2,3-triacetyl-12-hydroxy-octadec-9-enoic acid glyceryl ester Formula: C27H46O8 MolecularWeight: 498.64934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCC(C(=O)C)C(C(=O)C)(C(=O)C)C(=O)OCC(CO)O)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCC(C(=O)C)C(C(=O)C)(C(=O)C)C(=O)OCC(CO)O)O

InChI

InChI=1S/C27H46O8/c1-5-6-7-12-15-23(32)16-13-10-8-9-11-14-17-25(20(2)29)27(21(3)30,22(4)31)26(34)35-19-24(33)18-28/h10,13,23-25,28,32-33H,5-9,11-12,14-19H2,1-4H3/b13-10+