25-(hydroxymethyl)-25,26-bis(oxidanyl)pentacontane-24,27-dione

Systemtic Name: 25-(hydroxymethyl)-25,26-bis(oxidanyl)pentacontane-24,27-dione Openeye Name: 25,26-dihydroxy-25-(hydroxymethyl)pentacontane-24,27-dione CAS Name: 25,26-dihydroxy-25-(hydroxymethyl)pentacontane-24,27-dione IUPAC Name: 25,26-dihydroxy-25-(hydroxymethyl)pentacontane-24,27-dione Traditional Name: 25,26-dihydroxy-25-methylol-pentacontane-24,27-dione Formula: C51H100O5 MolecularWeight: 793.3367

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC(=O)C(C(CO)(C(=O)CCCCCCCCCCCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)C(C(CO)(C(=O)CCCCCCCCCCCCCCCCCCCCCCC)O)O

InChI

InChI=1S/C51H100O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-48(53)50(55)51(56,47-52)49(54)46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h50,52,55-56H,3-47H2,1-2H3