(E)-17-oxidanyl-16,19-bis(oxidanylidene)-18-(2-oxidanylideneheptadecyl)hexatriacont-27-en-18-olate

Systemtic Name: (E)-17-oxidanyl-16,19-bis(oxidanylidene)-18-(2-oxidanylideneheptadecyl)hexatriacont-27-en-18-olate Openeye Name: (E)-17-hydroxy-16,19-dioxo-18-(2-oxoheptadecyl)hexatriacont-27-en-18-olate CAS Name: (E)-17-hydroxy-16,19-dioxo-18-(2-oxoheptadecyl)-27-hexatriaconten-18-olate IUPAC Name: (E)-17-hydroxy-16,19-dioxo-18-(2-oxoheptadecyl)hexatriacont-27-en-18-olate Traditional Name: (E)-17-hydroxy-16,19-diketo-18-(2-ketoheptadecyl)hexatriacont-27-en-18-olate Formula: C53H99O5- MolecularWeight: 816.35016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCCCCCCCC)O)(C(=O)CCCCCCCC=CCCCCCCCC)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCCCCCCCC)O)(C(=O)CCCCCCC/C=C/CCCCCCCC)[O-]

InChI

InChI=1S/C53H99O5/c1-4-7-10-13-16-19-22-25-26-29-32-35-38-41-44-47-51(56)53(58,48-49(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2)52(57)50(55)46-43-40-37-34-31-28-24-21-18-15-12-9-6-3/h25-26,52,57H,4-24,27-48H2,1-3H3/q-1/b26-25+