NP-MRD: Showing NP-Card for 5,7,4'-Trihydroxy-6-methoxyisoflavone (NP0051491)

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Record Information

Version

2.0

Created at

2022-04-27 22:50:14 UTC

Updated at

2022-04-27 22:50:14 UTC

NP-MRD ID

NP0051491

Secondary Accession Numbers

None

Natural Product Identification

Common Name

5,7,4'-Trihydroxy-6-methoxyisoflavone

Description

Tectorigenin belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom. Thus, tectorigenin is considered to be a flavonoid lipid molecule. 5,7,4'-Trihydroxy-6-methoxyisoflavone is found in Artemisia minor, Baptisia spp., Centrosema spp., Dalbergia monetaria, Dalbergia odorifera , Dalbergia parviflora , Dalbergia riparia, Dalbergia sissoides, Dalbergia sissoo, Dalbergia stevensonii Standl., Dalbergia volubilis , Erythrina senegalensis, Euchresta formosana, Iris crocea, Iris dichotoma, Belamcanda chinensis , Iris germanica , Iris japonica, Iris kemaonensis, Iris milesii, Iris pseudacorus, Iris spuria, Iris tectorum , Maackia amurensis , Ononis spinosa , Pueraria montana, Sorbus cuspidata, Streptoverticillium album K-251 and Taxus chinensis. 5,7,4'-Trihydroxy-6-methoxyisoflavone was first documented in 2013 (PMID: 23461431). Tectorigenin is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral (PMID: 24380276) (PMID: 25480515) (PMID: 25856699).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 34 36  0  0  0  0  0  0  0  0999 V2000
    5.0608    1.5346   -1.0045 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5065    1.1994    0.2618 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4342    0.2878    0.2232 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6614   -1.0671    0.2989 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9896   -1.4733    0.4137 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6307   -1.9810    0.2634 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3184   -1.5633    0.1493 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3226   -2.4373    0.1146 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9280   -2.0658    0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2314   -0.7244   -0.0737 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6155   -0.2784   -0.1943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6375   -0.7936    0.5760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9506   -0.3525    0.4433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2534    0.6231   -0.4767 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5559    1.1101   -0.6586 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2466    1.1569   -1.2624 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9504    0.7066   -1.1162 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2203    0.2137   -0.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4250    1.4545   -0.1098 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0900   -0.2050    0.0733 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1321    0.7181    0.1092 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8840    2.0734    0.0319 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5221    0.6058   -1.4000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8466    2.3050   -0.9126 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2104    1.8651   -1.6453 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2633   -2.4404    0.4759 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8493   -3.0446    0.3258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7486   -2.7880   -0.0215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3842   -1.5628    1.2980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7107   -0.7732    1.0545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8313    1.9142   -0.0854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5157    1.9302   -1.9846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1765    1.1370   -1.7405 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6597    2.7153    0.0606 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3 21  2  0
 21 22  1  0
 21 20  1  0
 20  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 18  1  0
 18 19  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
  7  6  1  0
  6  4  2  0
  4  5  1  0
  4  3  1  0
 18 20  1  0
 17 11  1  0
  1 23  1  0
  1 24  1  0
  1 25  1  0
 22 34  1  0
  9 28  1  0
 12 29  1  0
 13 30  1  0
 15 31  1  0
 16 32  1  0
 17 33  1  0
  6 27  1  0
  5 26  1  0
M  END

 
  Mrv0541 02271201342D          
 
 22 24  0  0  0  0            999 V2000
   14.2432   -9.9974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2466   -9.1724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9582  -10.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5317  -10.4099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5317   -8.7566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9651   -8.7599    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6732  -10.0043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9925  -11.2382    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8133   -9.9974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5317  -11.2348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8167   -9.1690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6766   -9.1793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3881  -10.4201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1018  -10.4099    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1052   -8.7566    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3812  -11.2451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0996  -10.0111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3902   -9.9974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0927  -11.6610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8145  -10.4236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8111  -11.2486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5227  -11.6610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  9 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 19 21  2  0  0  0  0
 21 22  1  0  0  0  0
  7 12  2  0  0  0  0
  9 11  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0051491

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=C(O)C2=C(OC=C(C2=O)C2=CC=C(O)C=C2)C=C1O

> <INCHI_IDENTIFIER>
InChI=1S/C16H12O6/c1-21-16-11(18)6-12-13(15(16)20)14(19)10(7-22-12)8-2-4-9(17)5-3-8/h2-7,17-18,20H,1H3

> <INCHI_KEY>
OBBCRPUNCUPUOS-UHFFFAOYSA-N

> <FORMULA>
C16H12O6

> <MOLECULAR_WEIGHT>
300.2629

> <EXACT_MASS>
300.063388116

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_AVERAGE_POLARIZABILITY>
29.603611962186637

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methoxy-4H-chromen-4-one

> <ALOGPS_LOGP>
3.07

> <JCHEM_LOGP>
2.9192011239999993

> <ALOGPS_LOGS>
-3.56

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
8.905842960662193

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.120214589993886

> <JCHEM_PKA_STRONGEST_BASIC>
-4.322006250583535

> <JCHEM_POLAR_SURFACE_AREA>
96.22000000000001

> <JCHEM_REFRACTIVITY>
78.1461

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
8.33e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
tectorigenin

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 27-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE:                                                   
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   27-FEB-12         0                                  
HETATM    1  C   UNK     0      26.587 -18.662   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      26.594 -17.122   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      27.922 -19.438   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      25.259 -19.432   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      25.259 -16.346   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      27.935 -16.352   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0      29.257 -18.675   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      27.986 -20.978   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      23.918 -18.662   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0      25.259 -20.972   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0      23.925 -17.115   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      29.263 -17.135   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      30.591 -19.451   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0      22.590 -19.432   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0      22.596 -16.346   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      30.578 -20.991   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      31.919 -18.687   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      21.262 -18.662   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      31.906 -21.767   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      33.254 -19.457   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      33.247 -20.997   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      34.576 -21.767   0.000  0.00  0.00           O+0
CONECT    1    2    3    4                                                  
CONECT    2    1    5    6                                                  
CONECT    3    1    7    8                                                  
CONECT    4    1    9   10                                                  
CONECT    5    2   11                                                       
CONECT    6    2   12                                                       
CONECT    7    3   13   12                                                  
CONECT    8    3                                                            
CONECT    9    4   14   11                                                  
CONECT   10    4                                                            
CONECT   11    5   15    9                                                  
CONECT   12    6    7                                                       
CONECT   13    7   16   17                                                  
CONECT   14    9   18                                                       
CONECT   15   11                                                            
CONECT   16   13   19                                                       
CONECT   17   13   20                                                       
CONECT   18   14                                                            
CONECT   19   16   21                                                       
CONECT   20   17   21                                                       
CONECT   21   19   22   20                                                  
CONECT   22   21                                                            
MASTER        0    0    0    0    0    0    0    0   22    0   48    0
END

View in JSmol

Synonyms

Value	Source
5,7,4'-Trihydroxy-6-methoxyisoflavone	ChEBI
4',5',7-Trihydroxy-6-methoxyisoflavone	HMDB

Chemical Formula

C₁₆H₁₂O₆

Average Mass

300.2629 Da

Monoisotopic Mass

300.06339 Da

IUPAC Name

5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methoxy-4H-chromen-4-one

Traditional Name

tectorigenin

CAS Registry Number

Not Available

SMILES

COC1=C(O)C2=C(OC=C(C2=O)C2=CC=C(O)C=C2)C=C1O

InChI Identifier

InChI=1S/C16H12O6/c1-21-16-11(18)6-12-13(15(16)20)14(19)10(7-22-12)8-2-4-9(17)5-3-8/h2-7,17-18,20H,1H3

InChI Key

OBBCRPUNCUPUOS-UHFFFAOYSA-N

Experimental Spectra

Not Available

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Artemisia minor	Plant	KNApSAcK
Baptisia spp.	Plant	KNApSAcK
Centrosema spp.	Plant	KNApSAcK
Dalbergia monetaria	LOTUS Database	35616633
Dalbergia odorifera	Plant	KNApSAcK
Dalbergia parviflora	Plant	KNApSAcK
Dalbergia riparia	Plant	KNApSAcK
Dalbergia sissoides	LOTUS Database	35616633
Dalbergia sissoo	LOTUS Database	35616633
Dalbergia stevensonii Standl.	Plant	KNApSAcK
Dalbergia volubilis	Plant	KNApSAcK
Erythrina senegalensis	LOTUS Database	35616633
Euchresta formosana	LOTUS Database	35616633
Iris crocea	Plant	KNApSAcK
Iris dichotoma	Plant	KNApSAcK
Iris domestica	Plant	KNApSAcK
Iris germanica	Plant	KNApSAcK
Iris japonica	LOTUS Database	35616633
Iris kemaonensis	LOTUS Database	35616633
Iris milesii	LOTUS Database	35616633
Iris pseudacorus	LOTUS Database	35616633
Iris spuria	Plant	KNApSAcK
Iris tectorum	Plant	KNApSAcK
Maackia amurensis	Plant	KNApSAcK
Ononis spinosa	Plant	KNApSAcK
Pueraria montana	LOTUS Database	35616633
Sorbus cuspidata	LOTUS Database	35616633
Streptoverticillium album K-251	Bacteria	KNApSAcK
Taxus chinensis	Plant	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Isoflavonoids

Sub Class

Isoflav-2-enes

Direct Parent

Isoflavones

Alternative Parents

Substituents

Hydroxyisoflavonoid
Isoflavone
Chromone
Benzopyran
1-benzopyran
Anisole
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Alkyl aryl ether
Pyranone
Phenol
Monocyclic benzene moiety
Benzenoid
Pyran
Heteroaromatic compound
Vinylogous acid
Oxacycle
Organoheterocyclic compound
Ether
Organic oxygen compound
Hydrocarbon derivative
Organic oxide
Organooxygen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

methoxyisoflavone (CHEBI:9429 )
7-hydroxyisoflavones (CHEBI:9429 )
isoflavones (C10534 )
Isoflavonoids (C10534 )
Isoflavonoids (LMPK12050385 )

Physical Properties

State

Not Available

Experimental Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Predicted Properties

Property	Value	Source
logP	3.07	ALOGPS
logP	2.92	ChemAxon
logS	-3.6	ALOGPS
pKa (Strongest Acidic)	7.12	ChemAxon
pKa (Strongest Basic)	-4.3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	6	ChemAxon
Hydrogen Donor Count	3	ChemAxon
Polar Surface Area	96.22 Å²	ChemAxon
Rotatable Bond Count	2	ChemAxon
Refractivity	78.15 m³·mol⁻¹	ChemAxon
Polarizability	29.6 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

HMDB0042024

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Tectorigenin

METLIN ID

Not Available

PubChem Compound

5281811

PDB ID

Not Available

ChEBI ID

9429

Good Scents ID

Not Available

References

General References

Ha le M, Que do TN, Huyen do TT, Long PQ, Dat NT: Toxicity, analgesic and anti-inflammatory activities of tectorigenin. Immunopharmacol Immunotoxicol. 2013 Jun;35(3):336-40. doi: 10.3109/08923973.2013.770521. Epub 2013 Mar 6. [PubMed:23461431 ]
Zhang W, Zhang XX, Liu CF, Song RL, Wang JJ: [Study on chemical constituents of Kochia scoparia]. Zhong Yao Cai. 2013 Jun;36(6):921-4. [PubMed:24380276 ]
Ma CH, Liu JP, Qu R, Ma SP: Tectorigenin inhibits the inflammation of LPS-induced acute lung injury in mice. Chin J Nat Med. 2014 Nov;12(11):841-6. doi: 10.1016/S1875-5364(14)60126-6. [PubMed:25480515 ]
Li QY, Chen L, Yan MM, Shi XJ, Zhong MK: Tectorigenin regulates adipogenic differentiation and adipocytokines secretion via PPARgamma and IKK/NF-kappaB signaling. Pharm Biol. 2015;53(11):1567-75. doi: 10.3109/13880209.2014.993038. Epub 2015 Apr 9. [PubMed:25856699 ]

Showing NP-Card for 5,7,4'-Trihydroxy-6-methoxyisoflavone (NP0051491)

MOL for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

3D MOL for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

3D SDF for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

3D-SDF for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

PDB for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

3D PDB for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

SMILES for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

INCHI for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

Structure for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)

3D Structure for NP0051491 (5,7,4'-Trihydroxy-6-methoxyisoflavone)