6-[1,2-bis(oxidanyl)-3-oxidanylidene-heptadecan-2-yl]-6-pentadecanoyl-oxane-2,5-dione

Systemtic Name: 6-[1,2-bis(oxidanyl)-3-oxidanylidene-heptadecan-2-yl]-6-pentadecanoyl-oxane-2,5-dione Openeye Name: 6-[1-hydroxy-1-(hydroxymethyl)-2-oxo-hexadecyl]-6-pentadecanoyl-tetrahydropyran-2,5-dione CAS Name: 6-(1,2-dihydroxy-3-oxoheptadecan-2-yl)-6-(1-oxopentadecyl)oxane-2,5-dione IUPAC Name: 6-(1,2-dihydroxy-3-oxoheptadecan-2-yl)-6-pentadecanoyloxane-2,5-dione Traditional Name: 6-(1-hydroxy-2-keto-1-methylol-hexadecyl)-6-pentadecanoyl-tetrahydropyran-2,5-quinone Formula: C37H66O7 MolecularWeight: 622.91574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)C1(C(=O)CCC(=O)O1)C(CO)(C(=O)CCCCCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCC(=O)C1(C(=O)CCC(=O)O1)C(CO)(C(=O)CCCCCCCCCCCCCC)O

InChI

InChI=1S/C37H66O7/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(39)36(43,31-38)37(34(41)29-30-35(42)44-37)33(40)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h38,43H,3-31H2,1-2H3