6-(hydroxymethyl)-4,5-bis(oxidanyl)oxepan-3-one

Systemtic Name: 6-(hydroxymethyl)-4,5-bis(oxidanyl)oxepan-3-one Openeye Name: 4,5-dihydroxy-6-(hydroxymethyl)oxepan-3-one CAS Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-oxepanone IUPAC Name: 4,5-dihydroxy-6-(hydroxymethyl)oxepan-3-one Traditional Name: 4,5-dihydroxy-6-methylol-oxepan-3-one Formula: C7H12O5 MolecularWeight: 176.16718

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(=O)CO1)O)O)CO

Isomeric SMILES

C1C(C(C(C(=O)CO1)O)O)CO

InChI

InChI=1S/C7H12O5/c8-1-4-2-12-3-5(9)7(11)6(4)10/h4,6-8,10-11H,1-3H2