5-(hydroxymethyl)-5,6-bis(oxidanyl)docosane-4,7-dione

Systemtic Name: 5-(hydroxymethyl)-5,6-bis(oxidanyl)docosane-4,7-dione Openeye Name: 5,6-dihydroxy-5-(hydroxymethyl)docosane-4,7-dione CAS Name: 5,6-dihydroxy-5-(hydroxymethyl)docosane-4,7-dione IUPAC Name: 5,6-dihydroxy-5-(hydroxymethyl)docosane-4,7-dione Traditional Name: 5,6-dihydroxy-5-methylol-docosane-4,7-dione Formula: C23H44O5 MolecularWeight: 400.59246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(CO)(C(=O)CCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(CO)(C(=O)CCC)O)O

InChI

InChI=1S/C23H44O5/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-20(25)22(27)23(28,19-24)21(26)17-4-2/h22,24,27-28H,3-19H2,1-2H3