18-oxidanyl-16,19-bis(oxidanylidene)-17-(2-oxidanylidenepropyl)tetracontan-17-olate

Systemtic Name: 18-oxidanyl-16,19-bis(oxidanylidene)-17-(2-oxidanylidenepropyl)tetracontan-17-olate Openeye Name: 17-acetonyl-18-hydroxy-16,19-dioxo-tetracontan-17-olate CAS Name: 18-hydroxy-16,19-dioxo-17-(2-oxopropyl)-17-tetracontanolate IUPAC Name: 18-hydroxy-16,19-dioxo-17-(2-oxopropyl)tetracontan-17-olate Traditional Name: 17-acetonyl-18-hydroxy-16,19-diketo-tetracontan-17-olate Formula: C43H81O5- MolecularWeight: 678.10024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)C(C(CC(=O)C)(C(=O)CCCCCCCCCCCCCCC)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)C(C(CC(=O)C)(C(=O)CCCCCCCCCCCCCCC)[O-])O

InChI

InChI=1S/C43H81O5/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-25-26-28-30-32-34-36-40(45)42(47)43(48,38-39(3)44)41(46)37-35-33-31-29-27-24-17-15-13-11-9-7-5-2/h42,47H,4-38H2,1-3H3/q-1