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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 18:27:03 UTC
Update Date2023-02-21 17:23:30 UTC
HMDB IDHMDB0033695
Secondary Accession Numbers
  • HMDB33695
Metabolite Identification
Common NamePoppy acid
DescriptionPoppy acid belongs to the class of organic compounds known as pyranones and derivatives. Pyranones and derivatives are compounds containing a pyran ring which bears a ketone. Based on a literature review very few articles have been published on Poppy acid.
Structure
Data?1677000210
Synonyms
ValueSource
Poppy acidKEGG
3-Hydroxy-4-oxopyran-2,6-dicarboxylateGenerator, HMDB
3-Hydroxy-4-oxo-4H-pyran-2,6-dicarboxylic acidHMDB
3-Hydroxy-4-pyrone-2,6-dicarboxylic acidHMDB
Meconic acidHMDB
Opium acidHMDB
MeconateGenerator
Chemical FormulaC7H4O7
Average Molecular Weight200.1025
Monoisotopic Molecular Weight199.995702482
IUPAC Name3-hydroxy-4-oxo-4H-pyran-2,6-dicarboxylic acid
Traditional Name3-hydroxy-4-oxopyran-2,6-dicarboxylic acid
CAS Registry Number497-59-6
SMILES
OC(=O)C1=CC(=O)C(O)=C(O1)C(O)=O
InChI Identifier
InChI=1S/C7H4O7/c8-2-1-3(6(10)11)14-5(4(2)9)7(12)13/h1,9H,(H,10,11)(H,12,13)
InChI KeyZEGRKMXCOCRTCS-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as pyranones and derivatives. Pyranones and derivatives are compounds containing a pyran ring which bears a ketone.
KingdomOrganic compounds
Super ClassOrganoheterocyclic compounds
ClassPyrans
Sub ClassPyranones and derivatives
Direct ParentPyranones and derivatives
Alternative Parents
Substituents
  • Pyranone
  • Dicarboxylic acid or derivatives
  • Heteroaromatic compound
  • Vinylogous acid
  • Cyclic ketone
  • Oxacycle
  • Carboxylic acid
  • Carboxylic acid derivative
  • Organic oxygen compound
  • Organic oxide
  • Hydrocarbon derivative
  • Organooxygen compound
  • Aromatic heteromonocyclic compound
Molecular FrameworkAromatic heteromonocyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
Role
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point270 °CNot Available
Boiling PointNot AvailableNot Available
Water Solubility8.4 mg/mL at 25 °CNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
Predicted Chromatographic Properties
Spectra
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB011804
KNApSAcK IDC00051519
Chemspider ID10465112
KEGG Compound IDC20209
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkMeconic acid
METLIN IDNot Available
PubChem Compound10347
PDB IDNot Available
ChEBI IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .