(E)-25-[2,3-bis(oxidanyl)propoxy]pentacos-12-en-3-one

Systemtic Name: (E)-25-[2,3-bis(oxidanyl)propoxy]pentacos-12-en-3-one Openeye Name: (E)-25-(2,3-dihydroxypropoxy)pentacos-12-en-3-one CAS Name: (E)-25-(2,3-dihydroxypropoxy)-12-pentacosen-3-one IUPAC Name: (E)-25-(2,3-dihydroxypropoxy)pentacos-12-en-3-one Traditional Name: (E)-25-glyceryloxypentacos-12-en-3-one Formula: C28H54O4 MolecularWeight: 454.72596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CCCCCCCCC=CCCCCCCCCCCCCOCC(CO)O

Isomeric SMILES

CCC(=O)CCCCCCCC/C=C/CCCCCCCCCCCCOCC(CO)O

InChI

InChI=1S/C28H54O4/c1-2-27(30)23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-32-26-28(31)25-29/h5,7,28-29,31H,2-4,6,8-26H2,1H3/b7-5+