NP-MRD: Showing NP-Card for Tribenzoylbalsaminol F (NP0084439)

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Record Information

Version

2.0

Created at

2022-04-29 05:09:45 UTC

Updated at

2022-04-29 05:09:46 UTC

NP-MRD ID

NP0084439

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Tribenzoylbalsaminol F

Description

Tribenzoylbalsaminol F belongs to the class of organic compounds known as cucurbitacins. These are polycyclic compounds containing the tetracyclic cucurbitane nucleus skeleton, 19-(10->9b)-abeo-10alanost-5-ene (also known as 9b-methyl-19-nor lanosta-5-ene), with a variety of oxygenation functionalities at different positions. Tribenzoylbalsaminol F is found in Momordica balsamina . Tribenzoylbalsaminol F was first documented in 2011 (PMID: 22071523). Based on a literature review very few articles have been published on Tribenzoylbalsaminol F.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652304292207092D          

 60 66  0  0  1  0            999 V2000
    0.9821   -1.9412    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7018   -1.1653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2336   -0.5346    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0458   -0.6798    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5776   -0.0491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8641    0.3651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8616    0.7255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3897   -0.1943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9215    0.4364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7336    0.2912    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.2655    0.9219    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9852    1.6978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5170    2.3285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2367    3.1045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.7411   -1.2236    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2253   -3.5330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4081   -3.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2821   -3.9083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6284    0.1710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5745   -2.0366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  4  3  1  6  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  6  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 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
 13 18  1  0  0  0  0
 12 19  2  0  0  0  0
 10 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  1  0  0  0
 24 26  1  6  0  0  0
 26 27  1  1  0  0  0
 26 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 29 34  1  1  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
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M  END

     RDKit          3D

119125  0  0  0  0  0  0  0  0999 V2000
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M  END


  Mrv1652304292207092D          

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M  END
> <DATABASE_ID>
NP0084439

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@@]1(CC[C@@]2(C)[C@]3([H])[C@@H](OC(=O)C4=CC=CC=C4)C=C4[C@@]([H])(CC[C@H](OC(=O)C5=CC=CC=C5)C4(C)C)[C@]3(C)CC[C@]12C)[C@H](C)C[C@@H](OC(=O)C1=CC=CC=C1)C=C(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C51H62O6/c1-33(2)30-38(55-45(52)35-18-12-9-13-19-35)31-34(3)39-26-27-51(8)44-42(56-46(53)36-20-14-10-15-21-36)32-41-40(49(44,6)28-29-50(39,51)7)24-25-43(48(41,4)5)57-47(54)37-22-16-11-17-23-37/h9-23,30,32,34,38-40,42-44H,24-29,31H2,1-8H3/t34-,38+,39-,40-,42+,43+,44-,49+,50-,51+/m1/s1

> <INCHI_KEY>
CBPYGZZVJLABTM-MXHWHTTGSA-N

> <FORMULA>
C51H62O6

> <MOLECULAR_WEIGHT>
771.051

> <EXACT_MASS>
770.454639716

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
119

> <JCHEM_AVERAGE_POLARIZABILITY>
89.63199952598438

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1S,2S,5S,9S,10R,11S,14R,15R)-5-(benzoyloxy)-14-[(2R,4R)-4-(benzoyloxy)-6-methylhept-5-en-2-yl]-1,6,6,11,15-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-9-yl benzoate

> <ALOGPS_LOGP>
9.44

> <JCHEM_LOGP>
12.852561487666666

> <ALOGPS_LOGS>
-7.40

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
7

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-6.427990206421387

> <JCHEM_POLAR_SURFACE_AREA>
78.9

> <JCHEM_REFRACTIVITY>
227.23129999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
13

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.10e-05 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(1S,2S,5S,9S,10R,11S,14R,15R)-5-(benzoyloxy)-14-[(2R,4R)-4-(benzoyloxy)-6-methylhept-5-en-2-yl]-1,6,6,11,15-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-9-yl benzoate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 29-APR-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   29-APR-22         0                                  
HETATM    1  O   UNK     0       1.833  -3.624   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       1.310  -2.175   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0       2.303  -0.998   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0       3.819  -1.269   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       4.811  -0.092   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       3.480   0.682   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       5.342   1.354   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       6.327  -0.363   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       7.320   0.815   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       8.836   0.544   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0       9.829   1.721   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0       9.306   3.169   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      10.298   4.347   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       9.775   5.795   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      10.768   6.972   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      12.284   6.701   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      12.807   5.253   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      11.814   4.076   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       7.790   3.440   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0       9.359  -0.905   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      10.875  -1.176   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      12.091  -0.231   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      13.366  -1.095   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      12.938  -2.574   0.000  0.00  0.00           C+0
HETATM   25  H   UNK     0      14.450  -2.284   0.000  0.00  0.00           H+0
HETATM   26  C   UNK     0      13.883  -3.790   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      13.303  -5.217   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      15.408  -3.579   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      16.354  -4.795   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      15.773  -6.222   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      16.719  -7.437   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      18.244  -7.227   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      16.138  -8.864   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0      17.879  -4.585   0.000  0.00  0.00           O+0
HETATM   35  C   UNK     0      18.824  -5.800   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      20.350  -5.590   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      20.930  -4.163   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      22.456  -3.953   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0      23.401  -5.168   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      22.821  -6.595   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0      21.295  -6.806   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0      19.193  -7.296   0.000  0.00  0.00           O+0
HETATM   43  C   UNK     0      10.506   0.319   0.000  0.00  0.00           C+0
HETATM   44  C   UNK     0      11.399  -2.624   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0      12.070  -4.010   0.000  0.00  0.00           C+0
HETATM   46  C   UNK     0      10.406  -3.802   0.000  0.00  0.00           C+0
HETATM   47  C   UNK     0       8.890  -3.531   0.000  0.00  0.00           C+0
HETATM   48  H   UNK     0       9.883  -2.353   0.000  0.00  0.00           H+0
HETATM   49  C   UNK     0       8.367  -2.082   0.000  0.00  0.00           C+0
HETATM   50  C   UNK     0       7.374  -3.259   0.000  0.00  0.00           C+0
HETATM   51  C   UNK     0       6.851  -1.811   0.000  0.00  0.00           C+0
HETATM   52  H   UNK     0       5.335  -1.540   0.000  0.00  0.00           H+0
HETATM   53  C   UNK     0       5.858  -2.988   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0       4.342  -2.717   0.000  0.00  0.00           C+0
HETATM   55  C   UNK     0      -0.206  -1.904   0.000  0.00  0.00           C+0
HETATM   56  C   UNK     0      -1.199  -3.081   0.000  0.00  0.00           C+0
HETATM   57  C   UNK     0      -2.715  -2.810   0.000  0.00  0.00           C+0
HETATM   58  C   UNK     0      -3.238  -1.362   0.000  0.00  0.00           C+0
HETATM   59  C   UNK     0      -2.245  -0.185   0.000  0.00  0.00           C+0
HETATM   60  C   UNK     0      -0.729  -0.456   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   55                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   54                                                  
CONECT    5    4    6    7    8                                             
CONECT    6    5                                                            
CONECT    7    5                                                            
CONECT    8    5    9   51                                                  
CONECT    9    8   10                                                       
CONECT   10    9   11   20                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13   19                                                  
CONECT   13   12   14   18                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   13                                                       
CONECT   19   12                                                            
CONECT   20   10   21   48   49                                             
CONECT   21   20   22   43   44                                             
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25   26   44                                             
CONECT   25   24                                                            
CONECT   26   24   27   28                                                  
CONECT   27   26                                                            
CONECT   28   26   29                                                       
CONECT   29   28   30   34                                                  
CONECT   30   29   31                                                       
CONECT   31   30   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31                                                            
CONECT   34   29   35                                                       
CONECT   35   34   36   42                                                  
CONECT   36   35   37   41                                                  
CONECT   37   36   38                                                       
CONECT   38   37   39                                                       
CONECT   39   38   40                                                       
CONECT   40   39   41                                                       
CONECT   41   40   36                                                       
CONECT   42   35                                                            
CONECT   43   21                                                            
CONECT   44   21   24   45   46                                             
CONECT   45   44                                                            
CONECT   46   44   47                                                       
CONECT   47   46   49                                                       
CONECT   48   20                                                            
CONECT   49   20   47   50   51                                             
CONECT   50   49                                                            
CONECT   51   49    8   52   53                                             
CONECT   52   51                                                            
CONECT   53   51   54                                                       
CONECT   54   53    4                                                       
CONECT   55    2   56   60                                                  
CONECT   56   55   57                                                       
CONECT   57   56   58                                                       
CONECT   58   57   59                                                       
CONECT   59   58   60                                                       
CONECT   60   59   55                                                       
MASTER        0    0    0    0    0    0    0    0   60    0  132    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₅₁H₆₂O₆

Average Mass

771.0510 Da

Monoisotopic Mass

770.45464 Da

IUPAC Name

(1S,2S,5S,9S,10R,11S,14R,15R)-5-(benzoyloxy)-14-[(2R,4R)-4-(benzoyloxy)-6-methylhept-5-en-2-yl]-1,6,6,11,15-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-9-yl benzoate

Traditional Name

(1S,2S,5S,9S,10R,11S,14R,15R)-5-(benzoyloxy)-14-[(2R,4R)-4-(benzoyloxy)-6-methylhept-5-en-2-yl]-1,6,6,11,15-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-9-yl benzoate

CAS Registry Number

Not Available

SMILES

[H][C@@]1(CC[C@@]2(C)[C@]3([H])[C@@H](OC(=O)C4=CC=CC=C4)C=C4[C@@]([H])(CC[C@H](OC(=O)C5=CC=CC=C5)C4(C)C)[C@]3(C)CC[C@]12C)[C@H](C)C[C@@H](OC(=O)C1=CC=CC=C1)C=C(C)C

InChI Identifier

InChI=1S/C51H62O6/c1-33(2)30-38(55-45(52)35-18-12-9-13-19-35)31-34(3)39-26-27-51(8)44-42(56-46(53)36-20-14-10-15-21-36)32-41-40(49(44,6)28-29-50(39,51)7)24-25-43(48(41,4)5)57-47(54)37-22-16-11-17-23-37/h9-23,30,32,34,38-40,42-44H,24-29,31H2,1-8H3/t34-,38+,39-,40-,42+,43+,44-,49+,50-,51+/m1/s1

InChI Key

CBPYGZZVJLABTM-MXHWHTTGSA-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
Momordica balsamina	Plant	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as cucurbitacins. These are polycyclic compounds containing the tetracyclic cucurbitane nucleus skeleton, 19-(10->9b)-abeo-10alanost-5-ene (also known as 9b-methyl-19-nor lanosta-5-ene), with a variety of oxygenation functionalities at different positions.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Sub Class

Cucurbitacins

Direct Parent

Cucurbitacins

Alternative Parents

Substituents

Cucurbitacin skeleton
Triterpenoid
14-alpha-methylsteroid
Delta-5-steroid
Benzoate ester
Benzoic acid or derivatives
Tricarboxylic acid or derivatives
Benzoyl
Benzenoid
Monocyclic benzene moiety
Carboxylic acid ester
Carboxylic acid derivative
Hydrocarbon derivative
Organic oxide
Organic oxygen compound
Organooxygen compound
Aromatic homopolycyclic compound

Molecular Framework

Aromatic homopolycyclic 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	9.44	ALOGPS
logP	12.85	ChemAxon
logS	-7.4	ALOGPS
pKa (Strongest Basic)	-6.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	3	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	78.9 Å²	ChemAxon
Rotatable Bond Count	13	ChemAxon
Refractivity	227.23 m³·mol⁻¹	ChemAxon
Polarizability	89.63 Å³	ChemAxon
Number of Rings	7	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00053861

Chemspider ID

28493003

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

57395417

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Ramalhete C, da Cruz FP, Lopes D, Mulhovo S, Rosario VE, Prudencio M, Ferreira MJ: Triterpenoids as inhibitors of erythrocytic and liver stages of Plasmodium infections. Bioorg Med Chem. 2011 Dec 15;19(24):7474-81. doi: 10.1016/j.bmc.2011.10.044. Epub 2011 Oct 20. [PubMed:22071523 ]

Showing NP-Card for Tribenzoylbalsaminol F (NP0084439)

MOL for NP0084439 (Tribenzoylbalsaminol F)

3D MOL for NP0084439 (Tribenzoylbalsaminol F)

3D SDF for NP0084439 (Tribenzoylbalsaminol F)

3D-SDF for NP0084439 (Tribenzoylbalsaminol F)

PDB for NP0084439 (Tribenzoylbalsaminol F)

3D PDB for NP0084439 (Tribenzoylbalsaminol F)

SMILES for NP0084439 (Tribenzoylbalsaminol F)

INCHI for NP0084439 (Tribenzoylbalsaminol F)

Structure for NP0084439 (Tribenzoylbalsaminol F)

3D Structure for NP0084439 (Tribenzoylbalsaminol F)