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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-12 03:07:52 UTC
Update Date2022-03-07 02:57:01 UTC
HMDB IDHMDB0041443
Secondary Accession Numbers
  • HMDB41443
Metabolite Identification
Common NameMukolidine
DescriptionMukolidine belongs to the class of organic compounds known as carbazoles. Carbazoles are compounds containing a three ring system containing a pyrrole ring fused on either side to a benzene ring. Mukolidine has been detected, but not quantified in, herbs and spices. This could make mukolidine a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Mukolidine.
Structure
Thumb
Synonyms
ValueSource
3-Formyl-8-methoxycarbazoleHMDB
6-Formyl-1-methoxycarbazoleHMDB
8-Methoxy-9H-carbazole-3-carboxaldehyde, 9ciHMDB
Chemical FormulaC14H11NO2
Average Molecular Weight225.2426
Monoisotopic Molecular Weight225.078978601
IUPAC Name8-methoxy-9H-carbazole-3-carbaldehyde
Traditional Name8-methoxy-9H-carbazole-3-carbaldehyde
CAS Registry Number87264-45-7
SMILES
COC1=CC=CC2=C1NC1=C2C=C(C=O)C=C1
InChI Identifier
InChI=1S/C14H11NO2/c1-17-13-4-2-3-10-11-7-9(8-16)5-6-12(11)15-14(10)13/h2-8,15H,1H3
InChI KeyKSTPFEFAPRYLOZ-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as carbazoles. Carbazoles are compounds containing a three ring system containing a pyrrole ring fused on either side to a benzene ring.
KingdomOrganic compounds
Super ClassOrganoheterocyclic compounds
ClassIndoles and derivatives
Sub ClassCarbazoles
Direct ParentCarbazoles
Alternative Parents
Substituents
  • Carbazole
  • Indole
  • Anisole
  • Alkyl aryl ether
  • Aryl-aldehyde
  • Benzenoid
  • Pyrrole
  • Heteroaromatic compound
  • Ether
  • Azacycle
  • Hydrocarbon derivative
  • Aldehyde
  • Organooxygen compound
  • Organonitrogen compound
  • Organic oxide
  • Organopnictogen compound
  • Organic oxygen compound
  • Organic nitrogen compound
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
Role
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point152 - 155 °CNot Available
Boiling PointNot AvailableNot Available
Water Solubility6.49 mg/L @ 25 °C (est)The Good Scents Company Information System
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
Predicted Chromatographic Properties
Spectra
Biological Properties
Cellular Locations
  • Membrane
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 IDFDB021394
KNApSAcK IDC00024716
Chemspider ID30777570
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound53465568
PDB IDNot Available
ChEBI IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1892511
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.. .