3-ethanoyl-3-octadecyl-6,7-bis(oxidanyl)heptane-2,4-dione

Systemtic Name: 3-ethanoyl-3-octadecyl-6,7-bis(oxidanyl)heptane-2,4-dione Openeye Name: 3-acetyl-6,7-dihydroxy-3-octadecyl-heptane-2,4-dione CAS Name: 3-acetyl-6,7-dihydroxy-3-octadecylheptane-2,4-dione IUPAC Name: 3-acetyl-6,7-dihydroxy-3-octadecylheptane-2,4-dione Traditional Name: 3-acetyl-6,7-dihydroxy-3-stearyl-heptane-2,4-dione Formula: C27H50O5 MolecularWeight: 454.6829

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C(=O)C)(C(=O)C)C(=O)CC(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(C(=O)C)(C(=O)C)C(=O)CC(CO)O

InChI

InChI=1S/C27H50O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(23(2)29,24(3)30)26(32)21-25(31)22-28/h25,28,31H,4-22H2,1-3H3