NP-MRD: Showing NP-Card for 2',6'-Dihydroxy-4'-methoxydihydrochalcone (NP0055293)

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Record Information

Version

2.0

Created at

2022-04-28 01:23:54 UTC

Updated at

2022-04-28 01:23:54 UTC

NP-MRD ID

NP0055293

Secondary Accession Numbers

NP0138314

Natural Product Identification

Common Name

2',6'-Dihydroxy-4'-methoxydihydrochalcone

Description

1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenyl-1-propanone, also known as 2',6'-dihydroxy-4'-methoxydihydrochalcone, belongs to the class of organic compounds known as 2'-hydroxy-dihydrochalcones. These are organic compounds containing dihydrochalcone skeleton that carries a hydroxyl group at the 2'-position. Thus, 1-(2,6-dihydroxy-4-methoxyphenyl)-3-phenyl-1-propanone is considered to be a flavonoid lipid molecule. 2',6'-Dihydroxy-4'-methoxydihydrochalcone is found in Adiantum sulphureum, Boesenbergia rotunda, Cryptocarya idenburgensis, Mimulus aurantiacus, Etlingera littoralis, Greyia flanaganii, Lindera umbellata , Litsea glaucescens, Miliusa balansae, Mitrella kentii, Notholaena spp., Ononis natrix , Persicaria senegalensis, Piper aduncum , Piper hispidum, Piper hostmannianum, Piper hostmannianum var.berbicense, Piper longicaudatum, Pityrogramma calomelanos, Pityrogramma spp., Populus angustifolia, Populus balsamifera , Populus deltoides, Populus nigra and Sarcandra glabra. 2',6'-Dihydroxy-4'-methoxydihydrochalcone was first documented in 1994 (PMID: 8158163). 1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenyl-1-propanone is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral (PMID: 17397884) (PMID: 21680165) (PMID: 22516933).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 36 37  0  0  0  0  0  0  0  0999 V2000
    5.4920    1.1610    1.3951 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3263    0.4002    0.2350 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0613   -0.0354   -0.1368 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8450   -0.7813   -1.2606 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5588   -1.2327   -1.6517 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4427   -1.9676   -2.7826 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4677   -0.9045   -0.8605 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1160   -1.3206   -1.1987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0208   -2.0049   -2.2806 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1146   -1.0553   -0.4558 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8094    0.2355   -0.8638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0405    0.4311   -0.0587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0065    1.1186    1.1409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1829    1.2681    1.8444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3576    0.7423    1.3564 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4004    0.0568    0.1637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2258   -0.0896   -0.5336 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6957   -0.1478    0.2769 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6360    0.2026    1.0928 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9703    0.2797    0.6336 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5276    1.3932    1.6328 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9902    0.6133    2.2453 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8856    2.1030    1.2741 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6749   -1.0645   -1.9154 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7763   -2.4053   -3.3055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9671   -1.1392    0.6075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8249   -1.9058   -0.7148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1220    1.0833   -0.7624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0866    0.1651   -1.9558 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0646    1.5220    1.4999 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2189    1.7950    2.7868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3074    0.8438    1.8905 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3461   -0.3472   -0.1949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2807   -0.6356   -1.4757 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8142    0.7531    1.9173 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0961    0.8696    1.5336 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  5  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
  7 18  1  0
 18 19  1  0
 18 20  2  0
 20  3  1  0
 17 12  1  0
  1 21  1  0
  1 22  1  0
  1 23  1  0
  4 24  1  0
  6 25  1  0
 10 26  1  0
 10 27  1  0
 11 28  1  0
 11 29  1  0
 13 30  1  0
 14 31  1  0
 15 32  1  0
 16 33  1  0
 17 34  1  0
 19 35  1  0
 20 36  1  0
M  END


  Mrv0541 05061307492D          

 20 21  0  0  0  0            999 V2000
   -1.4289    8.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    5.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    6.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    8.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    4.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    7.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    8.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    7.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    7.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    7.4250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    8.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    6.1875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    8.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  2  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  2  0  0  0  0
  8  7  1  0  0  0  0
 11  5  2  0  0  0  0
 11  6  1  0  0  0  0
 11  7  1  0  0  0  0
 12  9  2  0  0  0  0
 12 10  1  0  0  0  0
 13  8  1  0  0  0  0
 14  9  1  0  0  0  0
 15 10  2  0  0  0  0
 16 13  1  0  0  0  0
 16 14  2  0  0  0  0
 16 15  1  0  0  0  0
 17 13  2  0  0  0  0
 18 14  1  0  0  0  0
 19 15  1  0  0  0  0
 20  1  1  0  0  0  0
 20 12  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0055293

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=CC(O)=C(C(=O)CCC2=CC=CC=C2)C(O)=C1

> <INCHI_IDENTIFIER>
InChI=1S/C16H16O4/c1-20-12-9-14(18)16(15(19)10-12)13(17)8-7-11-5-3-2-4-6-11/h2-6,9-10,18-19H,7-8H2,1H3

> <INCHI_KEY>
MDMCODCJMHTFIZ-UHFFFAOYSA-N

> <FORMULA>
C16H16O4

> <MOLECULAR_WEIGHT>
272.2958

> <EXACT_MASS>
272.104859

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
28.90865916711642

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
1-(2,6-dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one

> <ALOGPS_LOGP>
3.28

> <JCHEM_LOGP>
4.344999910333333

> <ALOGPS_LOGS>
-3.73

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
11.196809206858097

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.884429573166878

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6595854515999564

> <JCHEM_POLAR_SURFACE_AREA>
66.76

> <JCHEM_REFRACTIVITY>
76.2087

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
5.12e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
1-(2,6-dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0      -2.667  15.400   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       5.335   6.160   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       6.668   6.930   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       4.001   6.930   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       6.668   8.470   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       4.001   8.470   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       5.335  10.780   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       4.001  11.550   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       1.334  16.170   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       0.000  13.860   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       5.335   9.240   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       0.000  15.400   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.001  13.090   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       2.667  15.400   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       1.334  13.090   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       2.667  13.860   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       5.335  13.860   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       4.001  16.170   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0       1.334  11.550   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0      -1.334  16.170   0.000  0.00  0.00           O+0
CONECT    1   20                                                            
CONECT    2    3    4                                                       
CONECT    3    2    5                                                       
CONECT    4    2    6                                                       
CONECT    5    3   11                                                       
CONECT    6    4   11                                                       
CONECT    7    8   11                                                       
CONECT    8    7   13                                                       
CONECT    9   12   14                                                       
CONECT   10   12   15                                                       
CONECT   11    5    6    7                                                  
CONECT   12    9   10   20                                                  
CONECT   13    8   16   17                                                  
CONECT   14    9   16   18                                                  
CONECT   15   10   16   19                                                  
CONECT   16   13   14   15                                                  
CONECT   17   13                                                            
CONECT   18   14                                                            
CONECT   19   15                                                            
CONECT   20    1   12                                                       
MASTER        0    0    0    0    0    0    0    0   20    0   42    0
END

View in JSmol

Synonyms

Value	Source
1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one	HMDB
2',6'-Dihydroxy-4'-methoxy-b-phenylpropiophenone	HMDB
2',6'-Dihydroxy-4'-methoxydihydrochalcone	HMDB
2',6'-Dihydroxy-4'-methoxydihydrochalone	HMDB
2',6'-Dihydroxy-4'-methoxydihydro-chalcone	HMDB

Chemical Formula

C₁₆H₁₆O₄

Average Mass

272.2958 Da

Monoisotopic Mass

272.10486 Da

IUPAC Name

1-(2,6-dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one

Traditional Name

1-(2,6-dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one

CAS Registry Number

Not Available

SMILES

COC1=CC(O)=C(C(=O)CCC2=CC=CC=C2)C(O)=C1

InChI Identifier

InChI=1S/C16H16O4/c1-20-12-9-14(18)16(15(19)10-12)13(17)8-7-11-5-3-2-4-6-11/h2-6,9-10,18-19H,7-8H2,1H3

InChI Key

MDMCODCJMHTFIZ-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
Adiantum sulphureum	Plant	KNApSAcK
Boesenbergia rotunda	LOTUS Database	35616633
Cryptocarya idenburgensis	Plant	KNApSAcK
Diplacus aurantiacus	Plant	KNApSAcK
Etlingera littoralis	LOTUS Database	35616633
Greyia flanaganii	LOTUS Database	35616633
Lindera umbellata	Plant	KNApSAcK
Litsea glaucescens	Plant	KNApSAcK
Miliusa balansae	LOTUS Database	35616633
Mitrella kentii	Plant	KNApSAcK
Notholaena spp.	Plant	KNApSAcK
Ononis natrix	Plant	KNApSAcK
Persicaria senegalensis	LOTUS Database	35616633
Piper aduncum	Plant	KNApSAcK
Piper hispidum	LOTUS Database	35616633
Piper hostmannianum	LOTUS Database	35616633
Piper hostmannianum var.berbicense	Plant	KNApSAcK
Piper longicaudatum	LOTUS Database	35616633
Pityrogramma calomelanos	LOTUS Database	35616633
Pityrogramma spp.	Plant	KNApSAcK
Populus angustifolia	Plant	KNApSAcK
Populus balsamifera	Plant	KNApSAcK
Populus deltoides	Plant	KNApSAcK
Populus nigra	Plant	KNApSAcK
Sarcandra glabra	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as 2'-hydroxy-dihydrochalcones. These are organic compounds containing dihydrochalcone skeleton that carries a hydroxyl group at the 2'-position.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Sub Class

Chalcones and dihydrochalcones

Direct Parent

2'-Hydroxy-dihydrochalcones

Alternative Parents

Substituents

2'-hydroxy-dihydrochalcone
Cinnamylphenol
Alkyl-phenylketone
Butyrophenone
Methoxyphenol
Phenylketone
Anisole
Benzoyl
Phenoxy compound
Phenol ether
Resorcinol
Aryl ketone
Aryl alkyl ketone
Methoxybenzene
1-hydroxy-2-unsubstituted benzenoid
Phenol
1-hydroxy-4-unsubstituted benzenoid
Alkyl aryl ether
Monocyclic benzene moiety
Benzenoid
Vinylogous acid
Ketone
Ether
Organic oxide
Organooxygen compound
Organic oxygen compound
Hydrocarbon derivative
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

polyphenol (CHEBI:28523 )
monomethoxybenzene (CHEBI:28523 )
dihydrochalcones (CHEBI:28523 )
dihydrochalcones (C09644 )
Chalcones and dihydrochalcones (LMPK12120511 )

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	3.28	ALOGPS
logP	4.34	ChemAxon
logS	-3.7	ALOGPS
pKa (Strongest Acidic)	9.88	ChemAxon
pKa (Strongest Basic)	-3.7	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	66.76 Å²	ChemAxon
Rotatable Bond Count	5	ChemAxon
Refractivity	76.21 m³·mol⁻¹	ChemAxon
Polarizability	28.91 Å³	ChemAxon
Number of Rings	2	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

HMDB0034435

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

Not Available

METLIN ID

Not Available

PubChem Compound

169676

PDB ID

Not Available

ChEBI ID

28523

Good Scents ID

Not Available

References

General References

Portet B, Fabre N, Roumy V, Gornitzka H, Bourdy G, Chevalley S, Sauvain M, Valentin A, Moulis C: Activity-guided isolation of antiplasmodial dihydrochalcones and flavanones from Piper hostmannianum var. berbicense. Phytochemistry. 2007 May;68(9):1312-20. doi: 10.1016/j.phytochem.2007.02.006. Epub 2007 Mar 29. [PubMed:17397884 ]
Mapunya MB, Hussein AA, Rodriguez B, Lall N: Tyrosinase activity of Greyia flanaganii (Bolus) constituents. Phytomedicine. 2011 Aug 15;18(11):1006-12. doi: 10.1016/j.phymed.2011.03.013. Epub 2011 Jun 15. [PubMed:21680165 ]
Cabanillas BJ, Le Lamer AC, Castillo D, Arevalo J, Estevez Y, Rojas R, Valadeau C, Bourdy G, Sauvain M, Fabre N: Dihydrochalcones and benzoic acid derivatives from Piper dennisii. Planta Med. 2012 Jun;78(9):914-8. doi: 10.1055/s-0031-1298459. Epub 2012 Apr 19. [PubMed:22516933 ]
Orjala J, Wright AD, Behrends H, Folkers G, Sticher O, Ruegger H, Rali T: Cytotoxic and antibacterial dihydrochalcones from Piper aduncum. J Nat Prod. 1994 Jan;57(1):18-26. doi: 10.1021/np50103a003. [PubMed:8158163 ]

Showing NP-Card for 2',6'-Dihydroxy-4'-methoxydihydrochalcone (NP0055293)

MOL for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

3D MOL for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

3D SDF for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

3D-SDF for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

PDB for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

3D PDB for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

SMILES for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

INCHI for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

Structure for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)

3D Structure for NP0055293 (2',6'-Dihydroxy-4'-methoxydihydrochalcone)