NP-MRD: Showing NP-Card for 2',4',6'-Trihydroxy-3'-prenyldihydrochalcone (NP0055364)

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Record Information

Version

2.0

Created at

2022-04-28 01:26:15 UTC

Updated at

2022-04-28 01:26:15 UTC

NP-MRD ID

NP0055364

Secondary Accession Numbers

None

Natural Product Identification

Common Name

2',4',6'-Trihydroxy-3'-prenyldihydrochalcone

Description

3-Phenyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one 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, 3-phenyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one is considered to be a flavonoid lipid molecule. 2',4',6'-Trihydroxy-3'-prenyldihydrochalcone is found in Helichrysum argyrolepis. 3-Phenyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 46 47  0  0  0  0  0  0  0  0999 V2000
    5.4306    0.6976   -1.5294 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1266    0.9719   -0.1104 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6701    2.2120    0.5005 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4045    0.1616    0.6007 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8426   -1.0673    0.0564 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3770   -1.2000    0.2340 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9069   -2.0208    1.2142 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7094   -2.7508    2.0681 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5316   -2.1777    1.4226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3803   -1.5042    0.6397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7502   -1.7107    0.9080 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0788   -0.6693   -0.3569 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8885    0.0391   -1.1661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4347    0.8221   -2.0764 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3466   -0.0382   -1.0623 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9610    0.9856   -0.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4252    0.7374   -0.1497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1721    1.4009   -1.0948 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5343    1.1942   -1.1469 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1330    0.3323   -0.2599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3938   -0.3281    0.6800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0401   -0.1283    0.7383 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4562   -0.5122   -0.5656 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0048    0.2851   -1.5195 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8261   -0.3475   -1.6759 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2599    1.3453   -1.9105 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5575    0.8833   -2.1563 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7280    2.1052    0.8040 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5552    3.0541   -0.2398 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1100    2.5225    1.3992 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2078    0.4054    1.6474 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3995   -1.9329    0.4195 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0456   -1.0600   -1.0631 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7078   -2.7567    2.0683 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1546   -2.8314    2.2032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0326   -2.3318    1.6488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8116    0.1721   -2.1083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7518   -1.0155   -0.8312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5704    0.8525    0.8860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8024    2.0236   -0.5031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7276    2.0955   -1.8180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1007    1.7258   -1.8970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2097    0.1686   -0.3007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8147   -1.0237    1.4097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4169   -0.6307    1.4668 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6073    0.8441   -2.1770 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  2  3
  4  5  1  0
  5  6  1  0
  6 23  2  0
 23 24  1  0
 23 12  1  0
 12 13  1  0
 13 14  2  0
 13 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 12 10  2  0
 10 11  1  0
 10  9  1  0
  9  7  2  0
  7  8  1  0
  7  6  1  0
 22 17  1  0
  1 25  1  0
  1 26  1  0
  1 27  1  0
  3 28  1  0
  3 29  1  0
  3 30  1  0
  4 31  1  0
  5 32  1  0
  5 33  1  0
 24 46  1  0
 15 37  1  0
 15 38  1  0
 16 39  1  0
 16 40  1  0
 18 41  1  0
 19 42  1  0
 20 43  1  0
 21 44  1  0
 22 45  1  0
 11 36  1  0
  9 35  1  0
  8 34  1  0
M  END


  Mrv1652308171914542D          

 24 25  0  0  0  0            999 V2000
   -2.1434    6.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    7.4250    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
   -1.4289    7.4250    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
   -0.7145    7.0125    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
   -2.1434    7.0125    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    7.4250    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
    0.0000    8.2500    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
    1.4289    7.4250    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
    2.8579    7.4250    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
    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
  4  3  2  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  7  5  2  0  0  0  0
 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 13  1  1  0  0  0  0
 13  2  1  0  0  0  0
 13  8  2  0  0  0  0
 14  6  2  0  0  0  0
 14  7  1  0  0  0  0
 14  9  1  0  0  0  0
 15 10  1  0  0  0  0
 16 11  1  0  0  0  0
 17 12  2  0  0  0  0
 17 15  1  0  0  0  0
 18 12  1  0  0  0  0
 19 16  1  0  0  0  0
 19 18  2  0  0  0  0
 20 15  2  0  0  0  0
 20 19  1  0  0  0  0
 21 16  2  0  0  0  0
 22 17  1  0  0  0  0
 23 18  1  0  0  0  0
 24 20  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0055364

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(C)=CCC1=C(O)C(C(=O)CCC2=CC=CC=C2)=C(O)C=C1O

> <INCHI_IDENTIFIER>
InChI=1S/C20H22O4/c1-13(2)8-10-15-17(22)12-18(23)19(20(15)24)16(21)11-9-14-6-4-3-5-7-14/h3-8,12,22-24H,9-11H2,1-2H3

> <INCHI_KEY>
PFRVXBMLBGFRRU-UHFFFAOYSA-N

> <FORMULA>
C20H22O4

> <MOLECULAR_WEIGHT>
326.392

> <EXACT_MASS>
326.151809188

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
46

> <JCHEM_AVERAGE_POLARIZABILITY>
36.03928685351839

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
3-phenyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one

> <ALOGPS_LOGP>
3.72

> <JCHEM_LOGP>
5.927672853666667

> <ALOGPS_LOGS>
-4.07

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.563244818540175

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.7922956625054285

> <JCHEM_PKA_STRONGEST_BASIC>
-4.61019271423356

> <JCHEM_POLAR_SURFACE_AREA>
77.76

> <JCHEM_REFRACTIVITY>
95.96919999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.77e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
3-phenyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 17-AUG-19   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   17-AUG-19         0                                  
HETATM    1  C   UNK     0      -4.001  11.550   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -5.335  13.860   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       5.335   6.160   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       6.668   6.930   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       4.001   6.930   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       6.668   8.470   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       4.001   8.470   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -2.667  13.860   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       5.335  10.780   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -1.334  13.090   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       4.001  11.550   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       1.334  16.170   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       5.335   9.240   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       0.000  13.860   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       4.001  13.090   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       0.000  15.400   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       2.667  15.400   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       2.667  13.860   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       1.334  13.090   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       5.335  13.860   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      -1.334  16.170   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       4.001  16.170   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0       1.334  11.550   0.000  0.00  0.00           O+0
CONECT    1   13                                                            
CONECT    2   13                                                            
CONECT    3    4    5                                                       
CONECT    4    3    6                                                       
CONECT    5    3    7                                                       
CONECT    6    4   14                                                       
CONECT    7    5   14                                                       
CONECT    8   10   13                                                       
CONECT    9   11   14                                                       
CONECT   10    8   15                                                       
CONECT   11    9   16                                                       
CONECT   12   17   18                                                       
CONECT   13    1    2    8                                                  
CONECT   14    6    7    9                                                  
CONECT   15   10   17   20                                                  
CONECT   16   11   19   21                                                  
CONECT   17   12   15   22                                                  
CONECT   18   12   19   23                                                  
CONECT   19   16   18   20                                                  
CONECT   20   15   19   24                                                  
CONECT   21   16                                                            
CONECT   22   17                                                            
CONECT   23   18                                                            
CONECT   24   20                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   50    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₀H₂₂O₄

Average Mass

326.3920 Da

Monoisotopic Mass

326.15181 Da

IUPAC Name

3-phenyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one

Traditional Name

3-phenyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one

CAS Registry Number

Not Available

SMILES

CC(C)=CCC1=C(O)C(C(=O)CCC2=CC=CC=C2)=C(O)C=C1O

InChI Identifier

InChI=1S/C20H22O4/c1-13(2)8-10-15-17(22)12-18(23)19(20(15)24)16(21)11-9-14-6-4-3-5-7-14/h3-8,12,22-24H,9-11H2,1-2H3

InChI Key

PFRVXBMLBGFRRU-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
Helichrysum argyrolepis	Plant	KNApSAcK

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
Acylphloroglucinol derivative
Butyrophenone
Benzenetriol
Phloroglucinol derivative
Phenylketone
Aryl alkyl ketone
Aryl ketone
Benzoyl
Phenol
1-hydroxy-2-unsubstituted benzenoid
1-hydroxy-4-unsubstituted benzenoid
Benzenoid
Monocyclic benzene moiety
Vinylogous acid
Ketone
Polyol
Organic oxide
Organic oxygen compound
Organooxygen compound
Hydrocarbon derivative
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

Chalcones and dihydrochalcones (LMPK12120482 )

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	3.72	ALOGPS
logP	5.93	ChemAxon
logS	-4.1	ALOGPS
pKa (Strongest Acidic)	7.79	ChemAxon
pKa (Strongest Basic)	-4.6	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	3	ChemAxon
Polar Surface Area	77.76 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	95.97 m³·mol⁻¹	ChemAxon
Polarizability	36.04 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

HMDB0124930

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

FDB083851

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

42607676

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for 2',4',6'-Trihydroxy-3'-prenyldihydrochalcone (NP0055364)

MOL for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

3D MOL for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

3D SDF for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

3D-SDF for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

PDB for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

3D PDB for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

SMILES for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

INCHI for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

Structure for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)

3D Structure for NP0055364 (2',4',6'-Trihydroxy-3'-prenyldihydrochalcone)