4,4-bis(hydroxymethyl)-5-tetradecanoyloxy-pentanoic acid

Systemtic Name: 4,4-bis(hydroxymethyl)-5-tetradecanoyloxy-pentanoic acid Openeye Name: 4,4-bis(hydroxymethyl)-5-tetradecanoyloxy-pentanoic acid CAS Name: 4,4-bis(hydroxymethyl)-5-(1-oxotetradecoxy)pentanoic acid IUPAC Name: 4,4-bis(hydroxymethyl)-5-tetradecanoyloxypentanoic acid Traditional Name: 4,4-dimethylol-5-tetradecanoyloxy-valeric acid Formula: C21H40O6 MolecularWeight: 388.5387

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(CCC(=O)O)(CO)CO

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(CCC(=O)O)(CO)CO

InChI

InChI=1S/C21H40O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-20(26)27-18-21(16-22,17-23)15-14-19(24)25/h22-23H,2-18H2,1H3,(H,24,25)