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

Systemtic Name: 3-ethanoyl-3-icosyl-6,7-bis(oxidanyl)heptane-2,4-dione Openeye Name: 3-acetyl-6,7-dihydroxy-3-icosyl-heptane-2,4-dione CAS Name: 3-acetyl-3-eicosyl-6,7-dihydroxyheptane-2,4-dione IUPAC Name: 3-acetyl-6,7-dihydroxy-3-icosylheptane-2,4-dione Traditional Name: 3-acetyl-3-arachyl-6,7-dihydroxy-heptane-2,4-dione Formula: C29H54O5 MolecularWeight: 482.73606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(C(=O)C)(C(=O)C)C(=O)CC(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(C(=O)C)(C(=O)C)C(=O)CC(CO)O

InChI

InChI=1S/C29H54O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-29(25(2)31,26(3)32)28(34)23-27(33)24-30/h27,30,33H,4-24H2,1-3H3