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

Systemtic Name: 5-oxidanyl-4,8-bis(oxidanylidene)-6-propanoyl-heptacosan-6-olate Openeye Name: 5-hydroxy-4,8-dioxo-6-propanoyl-heptacosan-6-olate CAS Name: 5-hydroxy-4,8-dioxo-6-(1-oxopropyl)-6-heptacosanolate IUPAC Name: 5-hydroxy-4,8-dioxo-6-propanoylheptacosan-6-olate Traditional Name: 5-hydroxy-4,8-diketo-6-propionyl-heptacosan-6-olate Formula: C30H55O5- MolecularWeight: 495.7547

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H55O5/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-26(31)25-30(35,28(33)6-3)29(34)27(32)23-5-2/h29,34H,4-25H2,1-3H3/q-1