Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 17:29:55 UTC
Update Date2022-08-31 06:53:14 UTC
Metabolite IDMMDBc0027839
Metabolite Identification
Common Name(−)-1-hydroxyboivinianic acid
Description(-)-1-hydroxyboivinianic acid belongs to the class of organic compounds known as hydroxybenzoic acid derivatives. Hydroxybenzoic acid derivatives are compounds containing a hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxyl and a hydroxyl groups. Based on a literature review very few articles have been published on (-)-1-hydroxyboivinianic acid.
Structure
Synonyms
ValueSource
(-)-1-HydroxyboivinianateGenerator
Molecular FormulaC12H12O5
Average Mass236.223
Monoisotopic Mass236.068473486
IUPAC Name3-hydroxy-4-[(2S)-2-methyl-5-oxooxolan-2-yl]benzoic acid
Traditional Name3-hydroxy-4-[(2S)-2-methyl-5-oxooxolan-2-yl]benzoic acid
CAS Registry NumberNot Available
SMILES
C[C@]1(CCC(=O)O1)C1=C(O)C=C(C=C1)C(O)=O
InChI Identifier
InChI=1S/C12H12O5/c1-12(5-4-10(14)17-12)8-3-2-7(11(15)16)6-9(8)13/h2-3,6,13H,4-5H2,1H3,(H,15,16)/t12-/m0/s1
InChI KeyQBZZGMOAQWNCHR-LBPRGKRZSA-N