NP-MRD: Showing NP-Card for (2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one (NP0144409)

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Record Information

Version

2.0

Created at

2022-09-01 23:22:36 UTC

Updated at

2022-09-01 23:22:36 UTC

NP-MRD ID

NP0144409

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one

Description

Pongamol belongs to the class of organic compounds known as furanochalcones. Furanochalcones are compounds containing a furan ring fused to either ring of a chalcone moiety. Thus, pongamol is considered to be a flavonoid. (2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one is found in Millettia pulchra, Pongamia pinnata and Tephrosia purpurea. (2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one was first documented in 2007 (PMID: 17768528). Based on a literature review a significant number of articles have been published on Pongamol (PMID: 32840388) (PMID: 32147928) (PMID: 25116833) (PMID: 34203624) (PMID: 30448188) (PMID: 26426474).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 36 38  0  0  0  0  0  0  0  0999 V2000
   -2.9685   -2.4720    0.8033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9132   -1.1696    1.3562 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7402   -0.1023    0.4855 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4299    0.3533    0.1474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3457   -0.2804    0.8008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7090   -1.0544    1.8321 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0546   -0.3174    0.6492 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9257    0.1484   -0.1844 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5029    0.8909   -1.2589 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3884   -0.0491   -0.0881 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9966   -0.7469    0.9115 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3787   -0.9153    0.9690 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1477   -0.3594   -0.0135 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5895    0.3577   -1.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2124    0.4984   -1.0656 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3521    1.4081   -0.7140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5166    1.9884   -1.2243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7766    1.5496   -0.8999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9930    1.9241   -1.2424 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8822    1.1678   -0.6464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2304    0.2477    0.1282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8558    0.4878   -0.0299 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0086   -2.7800    0.5501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4019   -2.5263   -0.1624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5931   -3.2105    1.5417 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6230   -0.9127    1.4745 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9252    1.8154   -1.4024 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4153   -1.2061    1.7162 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8074   -1.4883    1.8001 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2227   -0.5058    0.0553 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1890    0.8010   -1.8320 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7447    1.0513   -1.8617 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4234    1.8615   -0.9945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4202    2.8293   -1.9123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9629    1.2507   -0.7452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6004   -0.5351    0.7608 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3 22  2  0
 22 21  1  0
 21 20  2  0
 20 19  1  0
 19 18  1  0
 18 17  2  0
 17 16  1  0
 16  4  2  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
  4  3  1  0
 15 10  1  0
 18 22  1  0
  1 23  1  0
  1 24  1  0
  1 25  1  0
 21 36  1  0
 20 35  1  0
 17 34  1  0
 16 33  1  0
  7 26  1  0
  9 27  1  0
 11 28  1  0
 12 29  1  0
 13 30  1  0
 14 31  1  0
 15 32  1  0
M  END


  Mrv1652309022201222D          

 22 24  0  0  0  0            999 V2000
    2.5645    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7079    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7079    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1368    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223    3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7079    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7079    4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223    4.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1368    4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1368    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798   -0.2549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2949    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798    1.0799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 10 15  1  0  0  0  0
  4 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
  3 22  2  0  0  0  0
 18 22  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0144409

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=C2C=COC2=CC=C1C(=O)\C=C(/O)C1=CC=CC=C1

> <INCHI_IDENTIFIER>
InChI=1S/C18H14O4/c1-21-18-13(7-8-17-14(18)9-10-22-17)16(20)11-15(19)12-5-3-2-4-6-12/h2-11,19H,1H3/b15-11-

> <INCHI_KEY>
IHWPQGIYXJKCOV-PTNGSMBKSA-N

> <FORMULA>
C18H14O4

> <MOLECULAR_WEIGHT>
294.306

> <EXACT_MASS>
294.089208931

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
36

> <JCHEM_AVERAGE_POLARIZABILITY>
31.010753394960098

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(2Z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one

> <ALOGPS_LOGP>
3.03

> <JCHEM_LOGP>
3.138230544999999

> <ALOGPS_LOGS>
-4.08

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
19.03838823861326

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.093055356003818

> <JCHEM_PKA_STRONGEST_BASIC>
-2.8641009847792844

> <JCHEM_POLAR_SURFACE_AREA>
59.67

> <JCHEM_REFRACTIVITY>
84.07360000000003

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.47e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2Z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 02-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   02-SEP-22         0                                  
HETATM    1  C   UNK     0       4.787   4.620   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       6.121   3.850   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       6.121   2.310   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       7.454   1.540   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       8.788   2.310   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      10.122   1.540   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       8.788   3.850   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      10.122   4.620   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      11.455   3.850   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      10.122   6.160   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       8.788   6.930   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       8.788   8.470   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      10.122   9.240   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      11.455   8.470   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      11.455   6.930   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       7.454   0.000   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.121  -0.770   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       4.787   0.000   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       3.322  -0.476   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0       2.417   0.770   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       3.322   2.016   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       4.787   1.540   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4   22                                                  
CONECT    4    3    5   16                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   11   15                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   10                                                       
CONECT   16    4   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19   22                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21    3   18                                                  
MASTER        0    0    0    0    0    0    0    0   22    0   48    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₈H₁₄O₄

Average Mass

294.3060 Da

Monoisotopic Mass

294.08921 Da

IUPAC Name

(2Z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one

Traditional Name

(2Z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one

CAS Registry Number

Not Available

SMILES

COC1=C2C=COC2=CC=C1C(=O)\C=C(/O)C1=CC=CC=C1

InChI Identifier

InChI=1S/C18H14O4/c1-21-18-13(7-8-17-14(18)9-10-22-17)16(20)11-15(19)12-5-3-2-4-6-12/h2-11,19H,1H3/b15-11-

InChI Key

IHWPQGIYXJKCOV-PTNGSMBKSA-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, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, 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
Millettia pulchra	LOTUS Database	35616633
Pongamia pinnata	LOTUS Database	35616633
Tephrosia purpurea	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as furanochalcones. Furanochalcones are compounds containing a furan ring fused to either ring of a chalcone moiety.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Sub Class

Chalcones and dihydrochalcones

Direct Parent

Furanochalcones

Alternative Parents

Substituents

Furanochalcone
Cinnamic acid or derivatives
Benzofuran
Anisole
Styrene
Aryl ketone
Alkyl aryl ether
Monocyclic benzene moiety
Benzenoid
Acryloyl-group
Heteroaromatic compound
Enone
Furan
Vinylogous acid
Alpha,beta-unsaturated ketone
Ketone
Ether
Enol
Oxacycle
Organoheterocyclic compound
Organic oxygen compound
Aldehyde
Organic oxide
Organooxygen compound
Hydrocarbon derivative
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

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	3.03	ALOGPS
logP	3.14	ChemAxon
logS	-4.1	ALOGPS
pKa (Strongest Acidic)	6.09	ChemAxon
pKa (Strongest Basic)	-2.9	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	3	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	59.67 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	84.07 m³·mol⁻¹	ChemAxon
Polarizability	31.01 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

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00007018

Chemspider ID

4478696

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

5320675

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Sahayaraj K, Kombiah P, Rathi JAM: A chalcone (Pongamol) and phytoconstituents of Tephrosia purpurea. Nat Prod Res. 2022 Apr;36(7):1870-1873. doi: 10.1080/14786419.2020.1808640. Epub 2020 Aug 25. [PubMed:32840388 ]
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Vo TH, Liaw CC, Lin YC, Nguyen DH, Nguyen TTN, Lee CK, Kuo YH: Quantification and Optimization of Ethanolic Extract Containing the Bioactive Flavonoids from Millettia pulchra Radix. Molecules. 2021 Jun 15;26(12):3641. doi: 10.3390/molecules26123641. [PubMed:34203624 ]
Sharma R, Williams IS, Gatchie L, Sonawane VR, Chaudhuri B, Bharate SB: Furanoflavones pongapin and lanceolatin B blocks the cell cycle and induce senescence in CYP1A1-overexpressing breast cancer cells. Bioorg Med Chem. 2018 Dec 15;26(23-24):6076-6086. doi: 10.1016/j.bmc.2018.11.013. Epub 2018 Nov 10. [PubMed:30448188 ]
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Sharma R, Vishwakarma RA, Bharate SB: An efficient transformation of furano-hydroxychalcones to furanoflavones via base mediated intramolecular tandem O-arylation and C-O bond cleavage: a new approach for the synthesis of furanoflavones. Org Biomol Chem. 2015 Nov 14;13(42):10461-5. doi: 10.1039/c5ob01802a. Epub 2015 Oct 1. [PubMed:26426474 ]
Putri HE, Sritularak B, Chanvorachote P: Pongamol Inhibits Epithelial to Mesenchymal Transition Through Suppression of FAK/Akt-mTOR Signaling. Anticancer Res. 2021 Dec;41(12):6147-6154. doi: 10.21873/anticanres.15434. [PubMed:34848469 ]
Jahan S, Mahmud MH, Khan Z, Alam A, Khalil AA, Rauf A, Tareq AM, Nainu F, Tareq SM, Emran TB, Khan M, Khan IN, Wilairatana P, Mubarak MS: Health promoting benefits of pongamol: An overview. Biomed Pharmacother. 2021 Oct;142:112109. doi: 10.1016/j.biopha.2021.112109. Epub 2021 Aug 27. [PubMed:34470730 ]
Lodhi S, Jain A, Jain AP, Pawar RS, Singhai AK: Effects of flavonoids from Martynia annua and Tephrosia purpurea on cutaneous wound healing. Avicenna J Phytomed. 2016 Sep-Oct;6(5):578-591. [PubMed:27761428 ]
Perumalsamy H, Jang MJ, Kim JR, Kadarkarai M, Ahn YJ: Larvicidal activity and possible mode of action of four flavonoids and two fatty acids identified in Millettia pinnata seed toward three mosquito species. Parasit Vectors. 2015 Apr 19;8:237. doi: 10.1186/s13071-015-0848-8. [PubMed:25928224 ]
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Tamrakar AK, Jaiswal N, Yadav PP, Maurya R, Srivastava AK: Pongamol from Pongamia pinnata stimulates glucose uptake by increasing surface GLUT4 level in skeletal muscle cells. Mol Cell Endocrinol. 2011 Jun 6;339(1-2):98-104. doi: 10.1016/j.mce.2011.03.023. Epub 2011 Apr 8. [PubMed:21497640 ]
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LOTUS database [Link]

Showing NP-Card for (2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one (NP0144409)

MOL for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

3D MOL for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

3D SDF for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

3D-SDF for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

PDB for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

3D PDB for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

SMILES for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

INCHI for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

Structure for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)

3D Structure for NP0144409 ((2z)-3-hydroxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one)