17-oxidanyl-16,20-bis(oxidanylidene)-18-(2-propylpentanoyl)pentatriacontan-18-olate

Systemtic Name: 17-oxidanyl-16,20-bis(oxidanylidene)-18-(2-propylpentanoyl)pentatriacontan-18-olate Openeye Name: 17-hydroxy-16,20-dioxo-18-(2-propylpentanoyl)pentatriacontan-18-olate CAS Name: 17-hydroxy-16,20-dioxo-18-(1-oxo-2-propylpentyl)-18-pentatriacontanolate IUPAC Name: 17-hydroxy-16,20-dioxo-18-(2-propylpentanoyl)pentatriacontan-18-olate Traditional Name: 17-hydroxy-16,20-diketo-18-(2-propylpentanoyl)pentatriacontan-18-olate Formula: C43H81O5- MolecularWeight: 678.10024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCCCCCCCC)O)(C(=O)C(CCC)CCC)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCCCCCCCC)O)(C(=O)C(CCC)CCC)[O-]

InChI

InChI=1S/C43H81O5/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-35-39(44)37-43(48,41(46)38(33-7-3)34-8-4)42(47)40(45)36-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h38,42,47H,5-37H2,1-4H3/q-1