2-[2,3-bis(oxidanyl)propanoyl]docosanoic acid

Systemtic Name: 2-[2,3-bis(oxidanyl)propanoyl]docosanoic acid Openeye Name: 2-(2,3-dihydroxypropanoyl)docosanoic acid CAS Name: 2-(2,3-dihydroxy-1-oxopropyl)docosanoic acid IUPAC Name: 2-(2,3-dihydroxypropanoyl)docosanoic acid Traditional Name: 2-glyceroylbehenic acid Formula: C25H48O5 MolecularWeight: 428.64562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(C(=O)C(CO)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(C(=O)C(CO)O)C(=O)O

InChI

InChI=1S/C25H48O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(25(29)30)24(28)23(27)21-26/h22-23,26-27H,2-21H2,1H3,(H,29,30)