| Common Name |
Norizalpinin
| Description |
Norizalpinin is found in apple. Norizalpinin is a constituent of Galanga root (Alpinia officinarum).Norizalpinin belongs to the family of Flavonols. These are compounds that has the 3-hydroxyflavone backbone.
| Structure |
MOLSDF3D-SDFPDBSMILESInChI View 3D Structure
Structure for HMDB29521 (Norizalpinin)
| Synonyms |
| Value |
Source |
3,5,7-Trihydroxy-2-phenyl-4H-benzopyran-4-oneChEBI
3,5,7-TrihydroxyflavoneChEBI
3,5,7-TriOH-flavoneChEBI
TeptochrysinChEBI
3,5,7-Trihydroxy-2-phenyl-4-benzopyroneHMDB
3,5,7-Trihydroxy-2-phenyl-4H-1-benzopyran-4-oneHMDB
3,5,7-Trihydroxy-2-phenyl-4H-1-benzopyran-4-one, 9ciHMDB
3,5,7-Trihydroxy-2-phenyl-4H-chromen-4-oneHMDB
3,5,7-Trihydroxy-flavoneHMDB
4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl- (9ci)HMDB
5,7-DihydroxyflavonolHMDB
GalanginHMDB
| Chemical Formlia |
C15H10O5
| Average Molecliar Weight |
270.2369
| Monoisotopic Molecliar Weight |
270.05282343
| IUPAC Name |
3,5,7-trihydroxy-2-phenyl-4H-chromen-4-one
| Traditional Name |
galangin
| CAS Registry Number |
548-83-4
| SMILES |
OC1=CC(O)=C2C(OC(=C(O)C2=O)C2=CC=CC=C2)=C1
| InChI Identifier |
InChI=1S/C15H10O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,16-17,19H
| InChI Key |
VCCRNZQBSJXYJD-UHFFFAOYSA-N
| Chemical Taxonomy |
| Description |
This compound belongs to the class of chemical entities known as flavonols. These are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position.
| Kingdom |
Chemical entities
| Super Class |
Organic compounds
| Class |
Phenylpropanoids and polyketides
| Sub Class |
Flavonoids
| Direct Parent |
Flavonols
| Alternative Parents |
7-hydroxyflavonoids
5-hydroxyflavonoids
3-hydroxyflavonoids
Chromones
Pyranones and derivatives
1-hydroxy-4-unsubstituted benzenoids
1-hydroxy-2-unsubstituted benzenoids
Benzene and substituted derivatives
Vinylogous acids
Heteroaromatic compounds
Polyols
Oxacyclic compounds
Organic oxides
Hydrocarbon derivatives
| Substituents |
3-hydroxyflavone
3-hydroxyflavonoid
5-hydroxyflavonoid
7-hydroxyflavonoid
Hydroxyflavonoid
Chromone
Benzopyran
1-benzopyran
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Pyranone
Monocyclic benzene moiety
Benzenoid
Pyran
Vinylogous acid
Heteroaromatic compound
Organoheterocyclic compound
Oxacycle
Polyol
Organooxygen compound
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Aromatic heteropolycyclic compound
| Molecliar Framework |
Aromatic heteropolycyclic compounds
| External Descriptors |
trihydroxyflavone (CHEBI:5262 )
7-hydroxyflavonol (CHEBI:5262 )
Flavones and Flavonols (C10044 )
Flavones and Flavonols (LMPK12111653 )
| Ontology |
| Status |
Expected but not Quantified
| Origin |
Endogenous
Food
| Biofunction |
Not Available
| Application |
Nutrient
| Cellliar locations |
Cytoplasm
Extracellliar
| Physical Properties |
| State |
Not Available
| Experimental Properties |
| Property |
Value |
Reference |
Melting Point217 – 218 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
| Predicted Properties |
| Property |
Value |
Source |
Water Solubility0.12 mg/mLALOGPS
logP2.39ALOGPS
logP2.76ChemAxon
logS-3.4ALOGPS
pKa (Strongest Acidic)6.45ChemAxon
pKa (Strongest Basic)-3.9ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count5ChemAxon
Hydrogen Donor Count3ChemAxon
Polar Surface Area86.99 Å2ChemAxon
Rotatable Bond Count1ChemAxon
Refractivity72.9 m3·mol-1ChemAxon
Polarizability26.54 Å3ChemAxon
Number of Rings3ChemAxon
Bioavailability1ChemAxon
Rlie of FiveYesChemAxon
Ghose FilterYesChemAxon
Vebers RlieYesChemAxon
MDDR-like RlieYesChemAxon
| Spectra |
| Spectra |
| Spectrum Type |
Description |
Splash Key |
|
| LC-MS/MS |
LC-MS/MS Spectrum – Linear Ion Trap , negativesplash10-01b9-0090000000-3dca6de83080ab540738View in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – Linear Ion Trap , negativesplash10-01b9-0090000000-c7a6c4b522f7d1ab344aView in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – Linear Ion Trap , negativesplash10-00mk-0690000000-9d8f0b599742e5233f85View in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , negativesplash10-014i-0090000000-a7d187f28c6a27ca6b7cView in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , negativesplash10-014i-0090000000-a7d187f28c6a27ca6b7cView in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , negativesplash10-014i-0980000000-5ead402f53f21ad1bc69View in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , negativesplash10-014i-0980000000-5ead402f53f21ad1bc69View in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , negativesplash10-014i-0090000000-573c015550a1005e3b91View in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , negativesplash10-014i-0090000000-573c015550a1005e3b91View in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , negativesplash10-014i-0090000000-041e54bbbd21adb90d8eView in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , negativesplash10-014i-0090000000-041e54bbbd21adb90d8eView in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – Linear Ion Trap , positivesplash10-01b9-0890000000-5debd5d2ff025ba5931fView in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – Linear Ion Trap , positivesplash10-001i-0390000000-83a37e0c64768aaefe97View in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – Linear Ion Trap , positivesplash10-03di-0090000000-b27a5ca6ccb0b7639df3View in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , positivesplash10-00di-0960000000-5a83d19652d9fddc19edView in MoNA
| LC-MS/MS |
LC-MS/MS Spectrum – , positivesplash10-00di-0590000000-3043a253d1c99a3ed366View in MoNA
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 10V, PositiveNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 20V, PositiveNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 40V, PositiveNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 10V, NegativeNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 20V, NegativeNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 40V, NegativeNot Available
| Biological Properties |
| Cellliar Locations |
Cytoplasm
Extracellliar
| Biofluid Locations |
Not Available
| Tissue Location |
Not Available
| Pathways |
Not Available
| Normal Concentrations |
| Not Available |
| Abnormal Concentrations |
|
Not Available
| Associated Disorders and Diseases |
| Disease References |
None
| Associated OMIM IDs |
None
| External Links |
| DrugBank ID |
Not Available
| DrugBank Metabolite ID |
Not Available
| Phenol Explorer Compound ID |
317
| Phenol Explorer Metabolite ID |
Not Available
| FoodDB ID |
FDB000657
| KNApSAcK ID |
C00004533
| Chemspider ID |
4444935
| KEGG Compound ID |
C10044
| BioCyc ID |
Not Available
| BiGG ID |
Not Available
| Wikipedia Link |
3,5,7-Trihydroxyflavone
| NuGOwiki Link |
HMDB29521
| Metagene Link |
HMDB29521
| METLIN ID |
Not Available
| PubChem Compound |
5281616
| PDB ID |
Not Available
| ChEBI ID |
5262
Product: glucagon receptor antagonists-4
References |
| Synthesis Reference |
Not Available |
| Material Safety Data Sheet (MSDS) |
Not Available |
| General References |
- (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .
|
PMID: 16618767
