3,5-dimethoxy-5-methyl-2,4,6-tris(oxidanyl)hexanoate

Systemtic Name: 3,5-dimethoxy-5-methyl-2,4,6-tris(oxidanyl)hexanoate Openeye Name: 2,4,6-trihydroxy-3,5-dimethoxy-5-methyl-hexanoate CAS Name: 2,4,6-trihydroxy-3,5-dimethoxy-5-methylhexanoate IUPAC Name: 2,4,6-trihydroxy-3,5-dimethoxy-5-methylhexanoate Traditional Name: 2,4,6-trihydroxy-3,5-dimethoxy-5-methyl-hexanoate Formula: C9H17O7- MolecularWeight: 237.22708

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(C(C(C(C(=O)[O-])O)OC)O)OC

Isomeric SMILES

CC(CO)(C(C(C(C(=O)[O-])O)OC)O)OC

InChI

InChI=1S/C9H18O7/c1-9(4-10,16-3)7(12)6(15-2)5(11)8(13)14/h5-7,10-12H,4H2,1-3H3,(H,13,14)/p-1