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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 17:35:17 UTC
Update Date2022-03-07 02:52:27 UTC
HMDB IDHMDB0030176
Secondary Accession Numbers
  • HMDB30176
Metabolite Identification
Common NameNorsanguinarine
DescriptionNorsanguinarine, also known as 2,3, belongs to the class of organic compounds known as phenanthridines and derivatives. These are polycyclic compounds containing a phenanthridine moiety, which is a tricyclic system with two benzene rings joined by a pyridine forming a non-linear skeleton. Hydrogenated derivatives are also included. Based on a literature review a significant number of articles have been published on Norsanguinarine.
Structure
Thumb
Synonyms
ValueSource
(1,3)Benzodioxolo(5,6-c)-1,3-dioxolo(4,5-I)phenanthridineHMDB
1,3-Dioxolo(I)(1,3)dioxolo(4,5)benzo(1,2-c)phenanthridineHMDB
1,3-Dioxolo[I][1,3]dioxolo[4,5]benzo[1,2-c]phenanthridineHMDB
13-Demethyl-sanguinarineHMDB
2,3HMDB
7,8-Bis(methylenedioxy)benzo[c]phenanthridineHMDB
DihydrosanguinarineHMDB
[1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-I]phenanthridineHMDB
13-DemethylsanguinarineHMDB
DemethylsanguinarineHMDB
N-NorsanguinarineHMDB
NorsanguinarineMeSH
Chemical FormulaC19H11NO4
Average Molecular Weight317.2949
Monoisotopic Molecular Weight317.068807845
IUPAC Name5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0^{2,10}.0^{4,8}.0^{14,22}.0^{17,21}]tetracosa-1(24),2,4(8),9,11,13,15,17(21),22-nonaene
Traditional Name5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0^{2,10}.0^{4,8}.0^{14,22}.0^{17,21}]tetracosa-1(24),2,4(8),9,11,13,15,17(21),22-nonaene
CAS Registry Number522-30-5
SMILES
C1OC2=C(O1)C=C1C(C=CC3=C4C=CC5=C(OCO5)C4=CN=C13)=C2
InChI Identifier
InChI=1S/C19H11NO4/c1-2-12-11-3-4-15-19(24-9-21-15)14(11)7-20-18(12)13-6-17-16(5-10(1)13)22-8-23-17/h1-7H,8-9H2
InChI KeyCNXVDVMAYXLWPD-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as phenanthridines and derivatives. These are polycyclic compounds containing a phenanthridine moiety, which is a tricyclic system with two benzene rings joined by a pyridine forming a non-linear skeleton. Hydrogenated derivatives are also included.
KingdomOrganic compounds
Super ClassOrganoheterocyclic compounds
ClassQuinolines and derivatives
Sub ClassBenzoquinolines
Direct ParentPhenanthridines and derivatives
Alternative Parents
Substituents
  • Phenanthridine
  • Isoquinoline
  • Naphthalene
  • Benzodioxole
  • Pyridine
  • Benzenoid
  • Heteroaromatic compound
  • Azacycle
  • Acetal
  • Oxacycle
  • Hydrocarbon derivative
  • Organooxygen compound
  • Organonitrogen compound
  • 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
RoleNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point285 - 287 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
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 IDFDB001992
KNApSAcK IDC00024657
Chemspider ID88162
KEGG Compound IDC05191
BioCyc IDDIHYDROSANGUINARINE
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound97679
PDB IDNot Available
ChEBI ID17209
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.. .