13-(hydroxymethyl)-13,14-bis(oxidanyl)triacontane-12,15-dione

Systemtic Name: 13-(hydroxymethyl)-13,14-bis(oxidanyl)triacontane-12,15-dione Openeye Name: 13,14-dihydroxy-13-(hydroxymethyl)triacontane-12,15-dione CAS Name: 13,14-dihydroxy-13-(hydroxymethyl)triacontane-12,15-dione IUPAC Name: 13,14-dihydroxy-13-(hydroxymethyl)triacontane-12,15-dione Traditional Name: 13,14-dihydroxy-13-methylol-triacontane-12,15-dione Formula: C31H60O5 MolecularWeight: 512.8051

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(CO)(C(=O)CCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(CO)(C(=O)CCCCCCCCCCC)O)O

InChI

InChI=1S/C31H60O5/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-28(33)30(35)31(36,27-32)29(34)26-24-22-20-17-12-10-8-6-4-2/h30,32,35-36H,3-27H2,1-2H3