(16Z)-16-[5-(hydroxymethyl)-2-oxidanylidene-5-(phenylmethoxymethyl)oxolan-3-ylidene]hexadecanoic acid

Systemtic Name: (16Z)-16-[5-(hydroxymethyl)-2-oxidanylidene-5-(phenylmethoxymethyl)oxolan-3-ylidene]hexadecanoic acid Openeye Name: (16Z)-16-[5-(benzyloxymethyl)-5-(hydroxymethyl)-2-oxo-tetrahydrofuran-3-ylidene]hexadecanoic acid CAS Name: (16Z)-16-[5-(hydroxymethyl)-2-oxo-5-(phenylmethoxymethyl)-3-oxolanylidene]hexadecanoic acid IUPAC Name: (16Z)-16-[5-(hydroxymethyl)-2-oxo-5-(phenylmethoxymethyl)oxolan-3-ylidene]hexadecanoic acid Traditional Name: (16Z)-16-[5-(benzoxymethyl)-2-keto-5-methylol-tetrahydrofuran-3-ylidene]palmitic acid Formula: C29H44O6 MolecularWeight: 488.65606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H44O6/c30-23-29(24-34-22-25-17-13-12-14-18-25)21-26(28(33)35-29)19-15-10-8-6-4-2-1-3-5-7-9-11-16-20-27(31)32/h12-14,17-19,30H,1-11,15-16,20-24H2,(H,31,32)/b26-19-