5-oxidanyl-4,8-bis(oxidanylidene)-6-propanoyl-nonacosan-6-olate

Systemtic Name: 5-oxidanyl-4,8-bis(oxidanylidene)-6-propanoyl-nonacosan-6-olate Openeye Name: 5-hydroxy-4,8-dioxo-6-propanoyl-nonacosan-6-olate CAS Name: 5-hydroxy-4,8-dioxo-6-(1-oxopropyl)-6-nonacosanolate IUPAC Name: 5-hydroxy-4,8-dioxo-6-propanoylnonacosan-6-olate Traditional Name: 5-hydroxy-4,8-diketo-6-propionyl-nonacosan-6-olate Formula: C32H59O5- MolecularWeight: 523.80786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H59O5/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-28(33)27-32(37,30(35)6-3)31(36)29(34)25-5-2/h31,36H,4-27H2,1-3H3/q-1