(20Z)-20-[5-(hydroxymethyl)-2-oxidanylidene-5-(phenylmethoxymethyl)oxolan-3-ylidene]icosanoic acid

Systemtic Name: (20Z)-20-[5-(hydroxymethyl)-2-oxidanylidene-5-(phenylmethoxymethyl)oxolan-3-ylidene]icosanoic acid Openeye Name: (20Z)-20-[5-(benzyloxymethyl)-5-(hydroxymethyl)-2-oxo-tetrahydrofuran-3-ylidene]icosanoic acid CAS Name: (20Z)-20-[5-(hydroxymethyl)-2-oxo-5-(phenylmethoxymethyl)-3-oxolanylidene]eicosanoic acid IUPAC Name: (20Z)-20-[5-(hydroxymethyl)-2-oxo-5-(phenylmethoxymethyl)oxolan-3-ylidene]icosanoic acid Traditional Name: (20Z)-20-[5-(benzoxymethyl)-2-keto-5-methylol-tetrahydrofuran-3-ylidene]arachidic acid Formula: C33H52O6 MolecularWeight: 544.76238

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CCCCCCCCCCCCCCCCCCCC(=O)O)C(=O)OC1(CO)COCC2=CC=CC=C2

Isomeric SMILES

C1/C(=C/CCCCCCCCCCCCCCCCCCC(=O)O)/C(=O)OC1(CO)COCC2=CC=CC=C2

InChI

InChI=1S/C33H52O6/c34-27-33(28-38-26-29-21-17-16-18-22-29)25-30(32(37)39-33)23-19-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-20-24-31(35)36/h16-18,21-23,34H,1-15,19-20,24-28H2,(H,35,36)/b30-23-