(E)-2-(hydroxymethyl)-1,2-bis(oxidanyl)icos-11-en-3-one

Systemtic Name: (E)-2-(hydroxymethyl)-1,2-bis(oxidanyl)icos-11-en-3-one Openeye Name: (E)-1,2-dihydroxy-2-(hydroxymethyl)icos-11-en-3-one CAS Name: (E)-1,2-dihydroxy-2-(hydroxymethyl)-11-eicosen-3-one IUPAC Name: (E)-1,2-dihydroxy-2-(hydroxymethyl)icos-11-en-3-one Traditional Name: (E)-1,2-dihydroxy-2-methylol-eicos-11-en-3-one Formula: C21H40O4 MolecularWeight: 356.5399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)21(25,18-22)19-23/h9-10,22-23,25H,2-8,11-19H2,1H3/b10-9+