3-(hydroxymethyl)-3,4-bis(oxidanyl)icosane-2,5-dione

Systemtic Name: 3-(hydroxymethyl)-3,4-bis(oxidanyl)icosane-2,5-dione Openeye Name: 3,4-dihydroxy-3-(hydroxymethyl)icosane-2,5-dione CAS Name: 3,4-dihydroxy-3-(hydroxymethyl)eicosane-2,5-dione IUPAC Name: 3,4-dihydroxy-3-(hydroxymethyl)icosane-2,5-dione Traditional Name: 3,4-dihydroxy-3-methylol-eicosane-2,5-dione Formula: C21H40O5 MolecularWeight: 372.5393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H40O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(24)20(25)21(26,17-22)18(2)23/h20,22,25-26H,3-17H2,1-2H3