3-(1-hydroxyethyl)-3,4-bis(oxidanyl)icosanoic acid

Systemtic Name: 3-(1-hydroxyethyl)-3,4-bis(oxidanyl)icosanoic acid Openeye Name: 3,4-dihydroxy-3-(1-hydroxyethyl)icosanoic acid CAS Name: 3,4-dihydroxy-3-(1-hydroxyethyl)eicosanoic acid IUPAC Name: 3,4-dihydroxy-3-(1-hydroxyethyl)icosanoic acid Traditional Name: 3,4-dihydroxy-3-(1-hydroxyethyl)arachidic acid Formula: C22H44O5 MolecularWeight: 388.58176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(CC(=O)O)(C(C)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(CC(=O)O)(C(C)O)O)O

InChI

InChI=1S/C22H44O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22(27,19(2)23)18-21(25)26/h19-20,23-24,27H,3-18H2,1-2H3,(H,25,26)