4-(hydroxymethyl)-4,5-bis(oxidanyl)-5-propanoyl-octane-3,6-dione

Systemtic Name: 4-(hydroxymethyl)-4,5-bis(oxidanyl)-5-propanoyl-octane-3,6-dione Openeye Name: 4,5-dihydroxy-4-(hydroxymethyl)-5-propanoyl-octane-3,6-dione CAS Name: 4,5-dihydroxy-4-(hydroxymethyl)-5-(1-oxopropyl)octane-3,6-dione IUPAC Name: 4,5-dihydroxy-4-(hydroxymethyl)-5-propanoyloctane-3,6-dione Traditional Name: 4,5-dihydroxy-4-methylol-5-propionyl-octane-3,6-dione Formula: C12H20O6 MolecularWeight: 260.2836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CO)(C(C(=O)CC)(C(=O)CC)O)O

Isomeric SMILES

CCC(=O)C(CO)(C(C(=O)CC)(C(=O)CC)O)O

InChI

InChI=1S/C12H20O6/c1-4-8(14)11(17,7-13)12(18,9(15)5-2)10(16)6-3/h13,17-18H,4-7H2,1-3H3