17-hexadecanoyl-18-(hydroxymethyl)-17,18-bis(oxidanyl)tetratriacontane-16,19-dione

Systemtic Name: 17-hexadecanoyl-18-(hydroxymethyl)-17,18-bis(oxidanyl)tetratriacontane-16,19-dione Openeye Name: 17-hexadecanoyl-17,18-dihydroxy-18-(hydroxymethyl)tetratriacontane-16,19-dione CAS Name: 17,18-dihydroxy-17-(hydroxymethyl)-18-(1-oxohexadecyl)tetratriacontane-16,19-dione IUPAC Name: 17-hexadecanoyl-17,18-dihydroxy-18-(hydroxymethyl)tetratriacontane-16,19-dione Traditional Name: 17-hexadecanoyl-17,18-dihydroxy-18-methylol-tetratriacontane-16,19-dione Formula: C51H98O6 MolecularWeight: 807.32022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(CO)(C(C(=O)CCCCCCCCCCCCCCC)(C(=O)CCCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(CO)(C(C(=O)CCCCCCCCCCCCCCC)(C(=O)CCCCCCCCCCCCCCC)O)O

InChI

InChI=1S/C51H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-47(53)50(56,46-52)51(57,48(54)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)49(55)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h52,56-57H,4-46H2,1-3H3