7-[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl]-7-(6-oxidanidyl-6-oxidanylidene-hexyl)tridecanedioate

Systemtic Name: 7-[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl]-7-(6-oxidanidyl-6-oxidanylidene-hexyl)tridecanedioate Openeye Name: 7-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-7-(6-oxido-6-oxo-hexyl)tridecanedioate CAS Name: 7-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-7-(6-oxido-6-oxohexyl)tridecanedioate IUPAC Name: 7-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-7-(6-oxido-6-oxohexyl)tridecanedioate Traditional Name: 7-(3-hydroxy-2,2-dimethylol-propyl)-7-(6-keto-6-oxido-hexyl)brassylate Formula: C24H41O9-3 MolecularWeight: 473.57694

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(=O)[O-])CCC(CCCCCC(=O)[O-])(CCCCCC(=O)[O-])CC(CO)(CO)CO

Isomeric SMILES

C(CCC(=O)[O-])CCC(CCCCCC(=O)[O-])(CCCCCC(=O)[O-])CC(CO)(CO)CO

InChI

InChI=1S/C24H44O9/c25-17-24(18-26,19-27)16-23(13-7-1-4-10-20(28)29,14-8-2-5-11-21(30)31)15-9-3-6-12-22(32)33/h25-27H,1-19H2,(H,28,29)(H,30,31)(H,32,33)/p-3