(E)-14-methyl-18-phenyl-17-[2,4,6-tris(oxidanyl)phenyl]carbonyl-octadec-17-enoic acid

Systemtic Name: (E)-14-methyl-18-phenyl-17-[2,4,6-tris(oxidanyl)phenyl]carbonyl-octadec-17-enoic acid Openeye Name: (E)-14-methyl-18-phenyl-17-(2,4,6-trihydroxybenzoyl)octadec-17-enoic acid CAS Name: (E)-14-methyl-17-[oxo-(2,4,6-trihydroxyphenyl)methyl]-18-phenyl-17-octadecenoic acid IUPAC Name: (E)-14-methyl-18-phenyl-17-(2,4,6-trihydroxybenzoyl)octadec-17-enoic acid Traditional Name: (E)-14-methyl-18-phenyl-17-(2,4,6-trihydroxybenzoyl)octadec-17-enoic acid Formula: C32H44O6 MolecularWeight: 524.68816

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCCCCC(=O)O)CCC(=CC1=CC=CC=C1)C(=O)C2=C(C=C(C=C2O)O)O

Isomeric SMILES

CC(CCCCCCCCCCCCC(=O)O)CC/C(=C\C1=CC=CC=C1)/C(=O)C2=C(C=C(C=C2O)O)O

InChI

InChI=1S/C32H44O6/c1-24(15-11-8-6-4-2-3-5-7-9-14-18-30(36)37)19-20-26(21-25-16-12-10-13-17-25)32(38)31-28(34)22-27(33)23-29(31)35/h10,12-13,16-17,21-24,33-35H,2-9,11,14-15,18-20H2,1H3,(H,36,37)/b26-21+