5-[2,3-bis(oxidanyl)-1-oxidanylidene-1-phenyl-propan-2-yl]-4-octadecoxy-3-oxidanyl-5-(phenylcarbonyl)furan-2-one

Systemtic Name: 5-[2,3-bis(oxidanyl)-1-oxidanylidene-1-phenyl-propan-2-yl]-4-octadecoxy-3-oxidanyl-5-(phenylcarbonyl)furan-2-one Openeye Name: 5-benzoyl-3-hydroxy-5-[1-hydroxy-1-(hydroxymethyl)-2-oxo-2-phenyl-ethyl]-4-octadecoxy-furan-2-one CAS Name: 5-benzoyl-5-(2,3-dihydroxy-1-oxo-1-phenylpropan-2-yl)-3-hydroxy-4-octadecoxy-2-furanone IUPAC Name: 5-benzoyl-5-(2,3-dihydroxy-1-oxo-1-phenylpropan-2-yl)-3-hydroxy-4-octadecoxyfuran-2-one Traditional Name: 5-benzoyl-3-hydroxy-5-(1-hydroxy-2-keto-1-methylol-2-phenyl-ethyl)-4-stearyloxy-furan-2-one Formula: C38H52O8 MolecularWeight: 636.81468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=C(C(=O)OC1(C(=O)C2=CC=CC=C2)C(CO)(C(=O)C3=CC=CC=C3)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=C(C(=O)OC1(C(=O)C2=CC=CC=C2)C(CO)(C(=O)C3=CC=CC=C3)O)O

InChI

InChI=1S/C38H52O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-28-45-35-32(40)36(43)46-38(35,34(42)31-26-21-18-22-27-31)37(44,29-39)33(41)30-24-19-17-20-25-30/h17-22,24-27,39-40,44H,2-16,23,28-29H2,1H3