(4S,5R,6S)-3-methyl-4,5,6-tris(oxidanyl)cyclohex-2-en-1-one

Systemtic Name: (4S,5R,6S)-3-methyl-4,5,6-tris(oxidanyl)cyclohex-2-en-1-one Openeye Name: (4S,5R,6S)-4,5,6-trihydroxy-3-methyl-cyclohex-2-en-1-one CAS Name: (4S,5R,6S)-4,5,6-trihydroxy-3-methyl-1-cyclohex-2-enone IUPAC Name: (4S,5R,6S)-4,5,6-trihydroxy-3-methylcyclohex-2-en-1-one Traditional Name: (4S,5R,6S)-4,5,6-trihydroxy-3-methyl-cyclohex-2-en-1-one Formula: C7H10O4 MolecularWeight: 158.1519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(C1O)O)O

Isomeric SMILES

CC1=CC(=O)[C@H]([C@@H]([C@H]1O)O)O

InChI

InChI=1S/C7H10O4/c1-3-2-4(8)6(10)7(11)5(3)9/h2,5-7,9-11H,1H3/t5-,6+,7+/m0/s1