(2S,4R,5S)-2,4,6-trimethyl-1,5-bis(oxidanyl)heptan-3-one

Systemtic Name: (2S,4R,5S)-2,4,6-trimethyl-1,5-bis(oxidanyl)heptan-3-one Openeye Name: (2S,4R,5S)-1,5-dihydroxy-2,4,6-trimethyl-heptan-3-one CAS Name: (2S,4R,5S)-1,5-dihydroxy-2,4,6-trimethyl-3-heptanone IUPAC Name: (2S,4R,5S)-1,5-dihydroxy-2,4,6-trimethylheptan-3-one Traditional Name: (2S,4R,5S)-1,5-dihydroxy-2,4,6-trimethyl-heptan-3-one Formula: C10H20O3 MolecularWeight: 188.264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](CO)C(=O)[C@H](C)[C@H](C(C)C)O

InChI

InChI=1S/C10H20O3/c1-6(2)9(12)8(4)10(13)7(3)5-11/h6-9,11-12H,5H2,1-4H3/t7-,8+,9-/m0/s1