Products 170382-11-3

CAS 170382-11-3 is the registry number for 7-Ketologanic acid. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

(1S,4aS,7R,7aS)-7-methyl-6-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,7,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid (CAS 170382-11-3) is a chemical compound with the molecular formula C16H22O10 and a molecular weight of 374.34 g/mol. IUPAC name: (1S,4aS,7R,7aS)-7-methyl-6-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,7,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid. InChIKey: HGYUBLMQZDQRSI-PZGZDOIQSA-N.

Identity
Molecular formulaC16H22O10
Molecular weight374.34 g/mol
IUPAC name(1S,4aS,7R,7aS)-7-methyl-6-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,7,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid
InChIKeyHGYUBLMQZDQRSI-PZGZDOIQSA-N
SMILESC[C@@H]1[C@@H]2[C@H](CC1=O)C(=CO[C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)O

Computed by PubChem (NCBI)