3-(hydroxymethyl)-3-oxidanyl-henicosanoic acid

Systemtic Name: 3-(hydroxymethyl)-3-oxidanyl-henicosanoic acid Openeye Name: 3-hydroxy-3-(hydroxymethyl)henicosanoic acid CAS Name: 3-hydroxy-3-(hydroxymethyl)heneicosanoic acid IUPAC Name: 3-hydroxy-3-(hydroxymethyl)henicosanoic acid Traditional Name: 3-hydroxy-3-methylol-heneicosanoic acid Formula: C22H44O4 MolecularWeight: 372.58236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CC(=O)O)(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CC(=O)O)(CO)O

InChI

InChI=1S/C22H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(26,20-23)19-21(24)25/h23,26H,2-20H2,1H3,(H,24,25)