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

Systemtic Name: 3-ethanoyl-3-hexadecyl-6,7-bis(oxidanyl)heptane-2,4-dione Openeye Name: 3-acetyl-3-hexadecyl-6,7-dihydroxy-heptane-2,4-dione CAS Name: 3-acetyl-3-hexadecyl-6,7-dihydroxyheptane-2,4-dione IUPAC Name: 3-acetyl-3-hexadecyl-6,7-dihydroxyheptane-2,4-dione Traditional Name: 3-acetyl-3-cetyl-6,7-dihydroxy-heptane-2,4-dione Formula: C25H46O5 MolecularWeight: 426.62974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)C)(C(=O)C)C(=O)CC(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)C)(C(=O)C)C(=O)CC(CO)O

InChI

InChI=1S/C25H46O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(21(2)27,22(3)28)24(30)19-23(29)20-26/h23,26,29H,4-20H2,1-3H3