(E)-18-hexadecanoyl-17,18,19-tris(oxidanyl)heptatriacont-28-ene-16,20-dione

Systemtic Name: (E)-18-hexadecanoyl-17,18,19-tris(oxidanyl)heptatriacont-28-ene-16,20-dione Openeye Name: (E)-18-hexadecanoyl-17,18,19-trihydroxy-heptatriacont-28-ene-16,20-dione CAS Name: (E)-17,18,19-trihydroxy-18-(1-oxohexadecyl)-28-heptatriacontene-16,20-dione IUPAC Name: (E)-18-hexadecanoyl-17,18,19-trihydroxyheptatriacont-28-ene-16,20-dione Traditional Name: (E)-18-hexadecanoyl-17,18,19-trihydroxy-heptatriacont-28-ene-16,20-dione Formula: C53H100O6 MolecularWeight: 833.3575

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCCC=CCCCCCCCC)O)(C(=O)CCCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCC/C=C/CCCCCCCC)O)(C(=O)CCCCCCCCCCCCCCC)O)O

InChI

InChI=1S/C53H100O6/c1-4-7-10-13-16-19-22-25-26-29-31-34-37-40-43-46-49(55)52(58)53(59,50(56)47-44-41-38-35-32-28-24-21-18-15-12-9-6-3)51(57)48(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2/h25-26,51-52,57-59H,4-24,27-47H2,1-3H3/b26-25+