NP-MRD: Showing NP-Card for Licochalcone C (NP0054754)

Jump To Section:

Identification Spectra BioTaxonomy ChemoTaxonomy Physical properties Links References XML

Record Information

Version

2.0

Created at

2022-04-28 01:00:21 UTC

Updated at

2022-04-28 01:00:21 UTC

NP-MRD ID

NP0054754

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Licochalcone C

Description

Licochalcone c belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions. Thus, licochalcone c is considered to be a flavonoid. Licochalcone C is found in Glycyrrhiza glabra , Glycyrrhiza inflata and Glycyrrhiza uralensis . Licochalcone C was first documented in 2020 (PMID: 33343964). Based on a literature review a small amount of articles have been published on Licochalcone c (PMID: 34873073) (PMID: 34183756) (PMID: 33291124) (PMID: 32009586).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 47 48  0  0  0  0  0  0  0  0999 V2000
    0.3061   -0.0414   -2.5694 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7195    0.3176   -1.2342 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8576   -0.6957   -0.3013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1645   -1.0929    0.5039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4737   -0.4632    0.5752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8023    0.6722    0.0766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0291    1.4149    0.0622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9335    2.5304   -0.6398 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2790    1.1351    0.6653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5372    0.2091    1.6149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8248   -0.0542    2.1274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8865    0.6716    1.6389 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1718    0.4637    2.0976 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6781    1.6247    0.6758 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4141    1.8488    0.2045 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0469   -2.1492    1.4304 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2849   -2.7213    1.4710 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3458   -2.3359    0.6663 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5791   -2.9368    0.7408 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1185   -1.3181   -0.2194 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1616   -0.8025   -1.1349 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7224    0.4885   -0.6624 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9991    0.7098   -0.3821 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3895    2.0840    0.0867 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0872   -0.2717   -0.4919 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4094   -1.1313   -2.7436 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8853    0.5798   -3.2810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7762    0.1838   -2.7028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2573   -1.0354    1.0589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9420    1.2169   -0.4152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7880   -0.3816    2.0993 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0008   -0.7994    2.8828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4744    1.0118    2.8908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5097    2.1875    0.3009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2291    2.5874   -0.5489 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7623   -2.4783    2.0791 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4700   -3.5329    2.1735 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3265   -2.6269    0.1533 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9139   -1.5446   -1.4407 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6409   -0.5493   -2.1127 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9870    1.2905   -0.5519 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9016    2.6566   -0.7102 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4815    2.6602    0.3539 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0687    1.9752    0.9695 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3784   -0.5467    0.5623 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8587   -1.1994   -1.0089 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9942    0.1886   -0.9629 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3 20  2  0
 20 21  1  0
 21 22  1  0
 22 23  2  3
 23 24  1  0
 23 25  1  0
 20 18  1  0
 18 19  1  0
 18 17  2  0
 17 16  1  0
 16  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 12 14  1  0
 14 15  2  0
  4  3  1  0
 15  9  1  0
  1 26  1  0
  1 27  1  0
  1 28  1  0
 21 39  1  0
 21 40  1  0
 22 41  1  0
 24 42  1  0
 24 43  1  0
 24 44  1  0
 25 45  1  0
 25 46  1  0
 25 47  1  0
 19 38  1  0
 17 37  1  0
 16 36  1  0
  5 29  1  0
  6 30  1  0
 10 31  1  0
 11 32  1  0
 13 33  1  0
 14 34  1  0
 15 35  1  0
M  END


  Mrv1652304282203002D          

 25 26  0  0  0  0            999 V2000
    3.5724   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.1250    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
    2.1434   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -3.7125    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
    2.1434   -5.3625    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
    2.8579   -6.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -6.6000    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
    0.7145   -7.8375    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
    0.0000   -6.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -6.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -7.8375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
  3 13  1  0  0  0  0
 13 14  1  0  0  0  0
  2 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 19 24  1  0  0  0  0
 22 25  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0054754

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=C(CC=C(C)C)C(O)=CC=C1\C=C\C(=O)C1=CC=C(O)C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C21H22O4/c1-14(2)4-11-18-20(24)13-8-16(21(18)25-3)7-12-19(23)15-5-9-17(22)10-6-15/h4-10,12-13,22,24H,11H2,1-3H3/b12-7+

> <INCHI_KEY>
WBDNTJSRHDSPSR-KPKJPENVSA-N

> <FORMULA>
C21H22O4

> <MOLECULAR_WEIGHT>
338.403

> <EXACT_MASS>
338.151809188

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
47

> <JCHEM_AVERAGE_POLARIZABILITY>
37.685406989713385

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(2E)-3-[4-hydroxy-2-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one

> <ALOGPS_LOGP>
4.43

> <JCHEM_LOGP>
4.854090399333334

> <ALOGPS_LOGS>
-5.09

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
8.956172035489244

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.8354512437791595

> <JCHEM_PKA_STRONGEST_BASIC>
-4.862001383009386

> <JCHEM_POLAR_SURFACE_AREA>
66.76

> <JCHEM_REFRACTIVITY>
101.5448

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.77e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
licochalcone C

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 28-APR-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   28-APR-22         0                                  
HETATM    1  C   UNK     0       6.668  -6.930   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       5.335  -7.700   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       4.001  -6.930   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       4.001  -5.390   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       6.668  -5.390   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       5.335  -3.080   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       2.667  -4.620   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       2.667  -7.700   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       1.334  -6.930   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.335  -9.240   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       4.001 -10.010   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       4.001 -11.550   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0       5.335 -12.320   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       2.667 -12.320   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       2.667 -13.860   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       1.334 -14.630   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       0.000 -13.860   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       0.000 -12.320   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       1.334 -11.550   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0      -1.334 -14.630   0.000  0.00  0.00           O+0
CONECT    1    2    6                                                       
CONECT    2    1    3   15                                                  
CONECT    3    2    4   13                                                  
CONECT    4    3    5    8                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5    1                                                       
CONECT    7    5                                                            
CONECT    8    4    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10                                                            
CONECT   13    3   14                                                       
CONECT   14   13                                                            
CONECT   15    2   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18   19                                                  
CONECT   18   17                                                            
CONECT   19   17   20   24                                                  
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23   25                                                  
CONECT   23   22   24                                                       
CONECT   24   23   19                                                       
CONECT   25   22                                                            
MASTER        0    0    0    0    0    0    0    0   25    0   52    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₁H₂₂O₄

Average Mass

338.4030 Da

Monoisotopic Mass

338.15181 Da

IUPAC Name

(2E)-3-[4-hydroxy-2-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one

Traditional Name

licochalcone C

CAS Registry Number

Not Available

SMILES

COC1=C(CC=C(C)C)C(O)=CC=C1\C=C\C(=O)C1=CC=C(O)C=C1

InChI Identifier

InChI=1S/C21H22O4/c1-14(2)4-11-18-20(24)13-8-16(21(18)25-3)7-12-19(23)15-5-9-17(22)10-6-15/h4-10,12-13,22,24H,11H2,1-3H3/b12-7+

InChI Key

WBDNTJSRHDSPSR-KPKJPENVSA-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
Glycyrrhiza glabra	Plant	KNApSAcK
Glycyrrhiza inflata	Plant	KNApSAcK
Glycyrrhiza uralensis	Plant	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Sub Class

Chalcones and dihydrochalcones

Direct Parent

Retrochalcones

Alternative Parents

Substituents

Retrochalcone
Cinnamylphenol
Cinnamic acid or derivatives
Hydroxycinnamic acid or derivatives
Methoxyphenol
Anisole
Benzoyl
Phenoxy compound
Phenol ether
Styrene
Aryl ketone
Methoxybenzene
Phenol
1-hydroxy-2-unsubstituted benzenoid
Alkyl aryl ether
Monocyclic benzene moiety
Benzenoid
Enone
Alpha,beta-unsaturated ketone
Acryloyl-group
Ketone
Ether
Organooxygen compound
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

Chalcones and dihydrochalcones (LMPK12120423 )

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	4.43	ALOGPS
logP	4.85	ChemAxon
logS	-5.1	ALOGPS
pKa (Strongest Acidic)	7.84	ChemAxon
pKa (Strongest Basic)	-4.9	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	6	ChemAxon
Refractivity	101.54 m³·mol⁻¹	ChemAxon
Polarizability	37.69 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

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00007056

Chemspider ID

8016522

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

9840805

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Park KH, Joo SH, Seo JH, Kim J, Yoon G, Jeon YJ, Lee MH, Chae JI, Kim WK, Shim JH: Licochalcone H Induces Cell Cycle Arrest and Apoptosis in Human Skin Cancer Cells by Modulating JAK2/STAT3 Signaling. Biomol Ther (Seoul). 2022 Jan 1;30(1):72-79. doi: 10.4062/biomolther.2021.149. [PubMed:34873073 ]
Zhang F, Liu W, Huang J, Chen QL, Wang DD, Zou LW, Zhao YF, Zhang WD, Xu JG, Chen HZ, Ge GB: Inhibition of drug-metabolizing enzymes by Jingyin granules: implications of herb-drug interactions in antiviral therapy. Acta Pharmacol Sin. 2022 Apr;43(4):1072-1081. doi: 10.1038/s41401-021-00697-2. Epub 2021 Jun 28. [PubMed:34183756 ]
Li T, Hua S, Ma J, Dong L, Xu F, Fu X: Spectrum-Effect Relationships of Flavonoids in Glycyrrhiza uralensis Fisch. J Anal Methods Chem. 2020 Dec 3;2020:8838290. doi: 10.1155/2020/8838290. eCollection 2020. [PubMed:33343964 ]
Song YQ, Guan XQ, Weng ZM, Liu JL, Chen J, Wang L, Cui LT, Fang SQ, Hou J, Ge GB: Discovery of hCES2A inhibitors from Glycyrrhiza inflata via combination of docking-based virtual screening and fluorescence-based inhibition assays. Food Funct. 2021 Jan 7;12(1):162-176. doi: 10.1039/d0fo02140g. Epub 2020 Dec 8. [PubMed:33291124 ]
Kwak AW, Choi JS, Liu K, Lee MH, Jeon YJ, Cho SS, Yoon G, Oh HN, Chae JI, Shim JH: Licochalcone C induces cell cycle G1 arrest and apoptosis in human esophageal squamous carcinoma cells by activation of the ROS/MAPK signaling pathway. J Chemother. 2020 May;32(3):132-143. doi: 10.1080/1120009X.2020.1721175. Epub 2020 Feb 3. [PubMed:32009586 ]

Showing NP-Card for Licochalcone C (NP0054754)

MOL for NP0054754 (Licochalcone C)

3D MOL for NP0054754 (Licochalcone C)

3D SDF for NP0054754 (Licochalcone C)

3D-SDF for NP0054754 (Licochalcone C)

PDB for NP0054754 (Licochalcone C)

3D PDB for NP0054754 (Licochalcone C)

SMILES for NP0054754 (Licochalcone C)

INCHI for NP0054754 (Licochalcone C)

Structure for NP0054754 (Licochalcone C)

3D Structure for NP0054754 (Licochalcone C)