2,2,3-tris(hydroxymethyl)octadecanoic acid

Systemtic Name: 2,2,3-tris(hydroxymethyl)octadecanoic acid Openeye Name: 2,2,3-tris(hydroxymethyl)octadecanoic acid CAS Name: 2,2,3-tris(hydroxymethyl)octadecanoic acid IUPAC Name: 2,2,3-tris(hydroxymethyl)octadecanoic acid Traditional Name: 2,2,3-trimethylolstearic acid Formula: C21H42O5 MolecularWeight: 374.55518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H42O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(16-22)21(17-23,18-24)20(25)26/h19,22-24H,2-18H2,1H3,(H,25,26)