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Showing NP-Card for Glycyrrhetic acid (NP0334056)

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Record Information
Version2.0
Created at2024-09-09 21:51:27 UTC
Updated at2024-09-09 21:51:27 UTC
NP-MRD IDNP0334056
Secondary Accession NumbersNone
Natural Product Identification
Common NameGlycyrrhetic acid
DescriptionAglycone from licorice (Glycyrrhiza glabra) Glycyrrhetinic acid is a pentacyclic triterpenoid derivative of the beta-amyrin type obtained from the hydrolysis of glycyrrhizic acid, which was obtained from the herb liquorice. It is used in flavoring and it masks the bitter taste of drugs like aloe and quinine. Glycyrrhetic acid is found in tea and herbs and spices.
Structure
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MOLSDFPDBSMILESInChI

MOL for NP0334056 (Glycyrrhetic acid)


  Mrv2104 05252300232D          

 38 42  0  0  1  0            999 V2000
    2.5886    0.1231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6701    0.6534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8079    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0771    3.1769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0954    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8341    0.1150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6829    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4454    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2704    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5079    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2204    0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6329    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9829    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1579    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7454    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3954    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1579    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9829    1.6500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9204    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2704    0.9355    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.0329    1.6500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.5079    1.6500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.9956    2.6466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4454    0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3954    0.9355    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.2204    2.3645    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6829    1.6500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.7454    0.9355    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.9204    0.9355    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5079    3.0789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2079    1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1389    3.4591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6276    2.1163    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5704    0.9355    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.2211    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6204    2.3645    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    1.6500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 25  1  0  0  0  0
  2 25  1  0  0  0  0
 26  3  1  6  0  0  0
 27  4  1  1  0  0  0
 28  5  1  6  0  0  0
 29  6  1  1  0  0  0
 30  7  1  6  0  0  0
  8 11  1  0  0  0  0
 21  8  1  0  0  0  0
  9 10  1  0  0  0  0
 22  9  1  0  0  0  0
 28 10  1  0  0  0  0
 30 11  1  0  0  0  0
 12 13  1  0  0  0  0
 26 12  1  0  0  0  0
 27 13  1  0  0  0  0
 14 15  1  0  0  0  0
 26 14  1  0  0  0  0
 29 15  1  0  0  0  0
 16 18  2  0  0  0  0
 16 20  1  0  0  0  0
 19 17  1  0  0  0  0
 27 17  1  0  0  0  0
 19 18  1  0  0  0  0
 29 18  1  0  0  0  0
 19 35  1  1  0  0  0
 19 26  1  0  0  0  0
 23 20  1  0  0  0  0
 20 31  2  0  0  0  0
 21 36  1  6  0  0  0
 21 25  1  0  0  0  0
 28 21  1  0  0  0  0
 22 37  1  6  0  0  0
 22 25  1  0  0  0  0
 22 32  1  0  0  0  0
 23 38  1  6  0  0  0
 23 28  1  0  0  0  0
 23 30  1  0  0  0  0
 27 24  1  6  0  0  0
 24 33  2  0  0  0  0
 24 34  1  0  0  0  0
 30 29  1  0  0  0  0
M  END
Download

3D MOL for NP0334056 (Glycyrrhetic acid)

Download
3D SDF for NP0334056 (Glycyrrhetic acid)

  Mrv2104 05252300232D          

 38 42  0  0  1  0            999 V2000
    2.5886    0.1231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6701    0.6534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8079    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0771    3.1769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0954    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8341    0.1150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6829    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4454    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2704    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5079    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2204    0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6329    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9829    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1579    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7454    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3954    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1579    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9829    1.6500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9204    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2704    0.9355    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.0329    1.6500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.5079    1.6500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.9956    2.6466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4454    0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3954    0.9355    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.2204    2.3645    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6829    1.6500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.7454    0.9355    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.9204    0.9355    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5079    3.0789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2079    1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1389    3.4591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6276    2.1163    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5704    0.9355    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.2211    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6204    2.3645    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    1.6500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 25  1  0  0  0  0
  2 25  1  0  0  0  0
 26  3  1  6  0  0  0
 27  4  1  1  0  0  0
 28  5  1  6  0  0  0
 29  6  1  1  0  0  0
 30  7  1  6  0  0  0
  8 11  1  0  0  0  0
 21  8  1  0  0  0  0
  9 10  1  0  0  0  0
 22  9  1  0  0  0  0
 28 10  1  0  0  0  0
 30 11  1  0  0  0  0
 12 13  1  0  0  0  0
 26 12  1  0  0  0  0
 27 13  1  0  0  0  0
 14 15  1  0  0  0  0
 26 14  1  0  0  0  0
 29 15  1  0  0  0  0
 16 18  2  0  0  0  0
 16 20  1  0  0  0  0
 19 17  1  0  0  0  0
 27 17  1  0  0  0  0
 19 18  1  0  0  0  0
 29 18  1  0  0  0  0
 19 35  1  1  0  0  0
 19 26  1  0  0  0  0
 23 20  1  0  0  0  0
 20 31  2  0  0  0  0
 21 36  1  6  0  0  0
 21 25  1  0  0  0  0
 28 21  1  0  0  0  0
 22 37  1  6  0  0  0
 22 25  1  0  0  0  0
 22 32  1  0  0  0  0
 23 38  1  6  0  0  0
 23 28  1  0  0  0  0
 23 30  1  0  0  0  0
 27 24  1  6  0  0  0
 24 33  2  0  0  0  0
 24 34  1  0  0  0  0
 30 29  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0334056

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@]1(O)CC[C@]2(C)[C@@]([H])(CC[C@@]3(C)[C@]2([H])C(=O)C=C2[C@]4([H])C[C@@](C)(CC[C@@]4(C)CC[C@]32C)C(O)=O)C1(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21-,22-,23+,26-,27+,28+,29-,30-/m0/s1

> <INCHI_KEY>
MPDGHEJMBKOTSU-VBUWQJNOSA-N

> <FORMULA>
C30H46O4

> <MOLECULAR_WEIGHT>
470.694

> <EXACT_MASS>
470.339609961

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
80

> <JCHEM_AVERAGE_POLARIZABILITY>
54.48101852631386

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2R,4aR,6aR,6bS,8aR,10S,12aR,12bR,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,4a,5,6,6a,6b,7,8,8a,10,11,12,12a,12b,14b-hexadecahydro-1H-picene-2-carboxylic acid

> <JCHEM_LOGP>
6.031328036333333

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
18.621396922000322

> <JCHEM_PKA_STRONGEST_ACIDIC>
4.44433188134718

> <JCHEM_PKA_STRONGEST_BASIC>
-0.8351069321304386

> <JCHEM_POLAR_SURFACE_AREA>
74.6

> <JCHEM_REFRACTIVITY>
134.26849999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
jintan

> <JCHEM_VEBER_RULE>
0

$$$$

Download
3D-SDF for NP0334056 (Glycyrrhetic acid)
Download
PDB for NP0334056 (Glycyrrhetic acid)
HEADER    PROTEIN                                 25-MAY-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   25-MAY-23         0                                  
HETATM    1  C   UNK     0       4.832   0.230   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       3.118   1.220   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      14.575   0.413   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      15.077   5.930   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       7.645   4.414   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       9.955   0.413   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       9.024   0.215   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       6.875   0.413   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       4.565   4.414   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       6.105   4.414   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       8.415   0.413   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      15.345   1.746   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      16.115   3.080   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      13.035   0.413   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      11.495   0.413   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      10.725   4.414   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      13.805   4.414   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      11.495   3.080   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      13.035   3.080   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       9.185   4.414   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       6.105   1.746   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       3.795   3.080   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       8.415   3.080   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      16.792   4.940   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       4.565   1.746   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      13.805   1.746   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      15.345   4.414   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       6.875   3.080   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      10.725   1.746   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       9.185   1.746   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0       8.415   5.747   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0       2.255   3.080   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0      17.059   6.457   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0      17.972   3.950   0.000  0.00  0.00           O+0
HETATM   35  H   UNK     0      12.265   1.746   0.000  0.00  0.00           H+0
HETATM   36  H   UNK     0       5.335   0.413   0.000  0.00  0.00           H+0
HETATM   37  H   UNK     0       3.025   4.414   0.000  0.00  0.00           H+0
HETATM   38  H   UNK     0       9.955   3.080   0.000  0.00  0.00           H+0
CONECT    1   25                                                            
CONECT    2   25                                                            
CONECT    3   26                                                            
CONECT    4   27                                                            
CONECT    5   28                                                            
CONECT    6   29                                                            
CONECT    7   30                                                            
CONECT    8   11   21                                                       
CONECT    9   10   22                                                       
CONECT   10    9   28                                                       
CONECT   11    8   30                                                       
CONECT   12   13   26                                                       
CONECT   13   12   27                                                       
CONECT   14   15   26                                                       
CONECT   15   14   29                                                       
CONECT   16   18   20                                                       
CONECT   17   19   27                                                       
CONECT   18   16   19   29                                                  
CONECT   19   17   18   35   26                                             
CONECT   20   16   23   31                                                  
CONECT   21    8   36   25   28                                             
CONECT   22    9   37   25   32                                             
CONECT   23   20   38   28   30                                             
CONECT   24   27   33   34                                                  
CONECT   25    1    2   21   22                                             
CONECT   26    3   12   14   19                                             
CONECT   27    4   13   17   24                                             
CONECT   28    5   10   21   23                                             
CONECT   29    6   15   18   30                                             
CONECT   30    7   11   23   29                                             
CONECT   31   20                                                            
CONECT   32   22                                                            
CONECT   33   24                                                            
CONECT   34   24                                                            
CONECT   35   19                                                            
CONECT   36   21                                                            
CONECT   37   22                                                            
CONECT   38   23                                                            
MASTER        0    0    0    0    0    0    0    0   38    0   84    0
END

Download
3D PDB for NP0334056 (Glycyrrhetic acid)
Download
SMILES for NP0334056 (Glycyrrhetic acid)
[H][C@]1(O)CC[C@]2(C)[C@@]([H])(CC[C@@]3(C)[C@]2([H])C(=O)C=C2[C@]4([H])C[C@@](C)(CC[C@@]4(C)CC[C@]32C)C(O)=O)C1(C)C
Download
INCHI for NP0334056 (Glycyrrhetic acid)
InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21-,22-,23+,26-,27+,28+,29-,30-/m0/s1
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View in JSmol
Synonyms
ValueSource
GlycyrrhetateGenerator
(2S,4AS,6as,6BR,8ar,10S,12as,12BR,14BR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,4a,5,6,6a,6b,7,8,8a,10,11,12,12a,12b,14b-hexadecahydro-1H-picene-2-carboxylateGenerator
Chemical FormulaC30H46O4
Average Mass470.6940 Da
Monoisotopic Mass470.33961 Da
IUPAC Name(2R,4aR,6aR,6bS,8aR,10S,12aR,12bR,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,4a,5,6,6a,6b,7,8,8a,10,11,12,12a,12b,14b-hexadecahydro-1H-picene-2-carboxylic acid
Traditional Namejintan
CAS Registry NumberNot Available
SMILES
[H][C@]1(O)CC[C@]2(C)[C@@]([H])(CC[C@@]3(C)[C@]2([H])C(=O)C=C2[C@]4([H])C[C@@](C)(CC[C@@]4(C)CC[C@]32C)C(O)=O)C1(C)C
InChI Identifier
InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21-,22-,23+,26-,27+,28+,29-,30-/m0/s1
InChI KeyMPDGHEJMBKOTSU-VBUWQJNOSA-N
Experimental Spectra
Not Available
Predicted Spectra
Not Available
Chemical Shift Submissions
Not Available
Species
Species of OriginNot Available
Chemical Taxonomy
Description Belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.
KingdomOrganic compounds  
Super ClassLipids and lipid-like molecules  
ClassPrenol lipids  
Sub ClassTriterpenoids  
Direct ParentTriterpenoids  
Alternative Parents
Substituents
  • Triterpenoid
    • 

  • Cyclohexenone
    • 

  • Cyclic alcohol
    • 

  • Secondary alcohol
    • 

  • Ketone
    • 

  • Monocarboxylic acid or derivatives
    • 

  • Carboxylic acid
    • 

  • Carboxylic acid derivative
    • 

  • Organic oxygen compound
    • 

  • Organic oxide
    • 

  • Hydrocarbon derivative
    • 

  • Organooxygen compound
    • 

  • Carbonyl group
    • 

  • Alcohol
    • 

  • Aliphatic homopolycyclic compound
Molecular FrameworkAliphatic homopolycyclic compounds
External DescriptorsNot Available
Physical Properties
StateNot Available
Experimental Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Predicted Properties
PropertyValueSource
logP6.03ChemAxon
pKa (Strongest Acidic)4.44ChemAxon
pKa (Strongest Basic)-0.84ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count2ChemAxon
Polar Surface Area74.6 ŲChemAxon
Rotatable Bond Count1ChemAxon
Refractivity134.27 m³·mol⁻¹ChemAxon
Polarizability54.48 ųChemAxon
Number of Rings5ChemAxon
BioavailabilityYesChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
HMDB IDNot Available
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FoodDB IDNot Available
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound170924268  
PDB IDNot Available
ChEBI IDNot Available
Good Scents IDNot Available
References
General References
  1. Akash S, Bayil I, Mahmood S, Mukerjee N, Mili TA, Dhama K, Rahman MA, Maitra S, Mohany M, Al-Rejaie SS, Ali N, Semwal P, Sharma R: Mechanistic inhibition of gastric cancer-associated bacteria Helicobacter pylori by selected phytocompounds: A new cutting-edge computational approach. Heliyon. 2023 Oct 5;9(10):e20670. doi: 10.1016/j.heliyon.2023.e20670. eCollection  2023 Oct. [PubMed:37876433  ] 
  2. Rakhimova MB, Esanov RS, Merzlyak PG, Gafurov MB, Kurbannazarova RS, Matchanov OD, Sabirov RZ: Effect of Glycyrrhetic Acid Derivatives on Regulation of Thymocyte Volume. Bull Exp Biol Med. 2023 May;175(1):27-31. doi: 10.1007/s10517-023-05804-3. Epub  2023 Jun 20. [PubMed:37338755  ] 
  3. Li K, Liu X, Hou R, Zhao H, Zhao P, Tian Y, Li J: Uncovering mechanisms of Baojin Chenfei formula treatment for silicosis by inhibiting inflammation and fibrosis based on serum pharmacochemistry and network analysis. Ecotoxicol Environ Saf. 2023 Jul 15;260:115082. doi:  10.1016/j.ecoenv.2023.115082. Epub 2023 May 29. [PubMed:37257350  ]