6-[5-(2-octadecanoyloxy-1-oxidanyl-ethyl)-4-oxidanyl-oxolan-3-yl]oxy-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[5-(2-octadecanoyloxy-1-oxidanyl-ethyl)-4-oxidanyl-oxolan-3-yl]oxy-6-oxidanylidene-hexanoic acid Openeye Name: 6-[4-hydroxy-5-(1-hydroxy-2-octadecanoyloxy-ethyl)tetrahydrofuran-3-yl]oxy-6-oxo-hexanoic acid CAS Name: 6-[[4-hydroxy-5-[1-hydroxy-2-(1-oxooctadecoxy)ethyl]-3-oxolanyl]oxy]-6-oxohexanoic acid IUPAC Name: 6-[4-hydroxy-5-(1-hydroxy-2-octadecanoyloxyethyl)oxolan-3-yl]oxy-6-oxohexanoic acid Traditional Name: 6-[4-hydroxy-5-(1-hydroxy-2-stearoyloxy-ethyl)tetrahydrofuran-3-yl]oxy-6-keto-hexanoic acid Formula: C30H54O9 MolecularWeight: 558.74436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(C1C(C(CO1)OC(=O)CCCCC(=O)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(C1C(C(CO1)OC(=O)CCCCC(=O)O)O)O

InChI

InChI=1S/C30H54O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-27(34)37-22-24(31)30-29(36)25(23-38-30)39-28(35)21-18-17-19-26(32)33/h24-25,29-31,36H,2-23H2,1H3,(H,32,33)