NP-MRD: Showing NP-Card for Suttonigenin F (NP0352732)

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Record Information

Version

2.0

Created at

2026-02-15 04:49:16 UTC

Updated at

2026-02-15 08:01:41 UTC

NP-MRD ID

NP0352732

Natural Product DOI

https://doi.org/10.57994/7021

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Suttonigenin F

Description

Suttonigenin F was first documented in 2019 (PMID: 31596585).

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 03162302022D          

 47 53  0  0  1  0            999 V2000
    7.7973   -1.4576    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9311   -2.2716    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.6640   -1.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2507   -2.4728    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.7040   -3.1621    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0743   -2.4249    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.6210   -1.7356    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4446   -1.6877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2682   -1.6397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7215   -2.3290    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.1748   -3.0183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.5451   -2.2811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9984   -2.9704    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.8221   -2.9224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6282   -3.7076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.7112   -5.1341    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1645   -5.8234    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.9881   -5.7755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7942   -6.5606    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.2476   -7.2499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9706   -6.6086    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.6003   -7.3458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5173   -5.9193    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.6937   -5.9672    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3512   -3.0662    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.9810   -3.8035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5276   -3.1142    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.8979   -2.3769    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1573   -3.8514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3337   -3.8994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8804   -3.2101    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4351   -3.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0648   -3.0857    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.3276   -2.7154    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3319   -3.4645    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2076   -4.2801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7452   -2.8845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.6399   -3.7902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1170   -3.1521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3030   -3.2858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4082   -2.3802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2223   -2.2464    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1155   -2.1473    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2  3  1  0  0  0  0
  4  3  1  0  0  0  0
  4  5  1  6  0  0  0
  6  4  1  0  0  0  0
  6  7  1  1  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
 10  9  1  0  0  0  0
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 30 31  1  6  0  0  0
 30 32  1  0  0  0  0
 32 33  1  0  0  0  0
 34 33  1  0  0  0  0
  4 34  1  0  0  0  0
 34 35  1  1  0  0  0
 34 36  1  0  0  0  0
 36  2  1  0  0  0  0
 36 37  1  6  0  0  0
 36 38  1  0  0  0  0
 38 39  1  6  0  0  0
 38 40  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 43 44  2  0  0  0  0
 43 45  1  0  0  0  0
 45 46  1  0  0  0  0
 40 46  1  0  0  0  0
 40 47  1  0  0  0  0
  2 47  1  0  0  0  0
M  END


  Mrv2104 03162302022D          

 47 53  0  0  1  0            999 V2000
    7.7973   -1.4576    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9311   -2.2716    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.6640   -1.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2507   -2.4728    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.7040   -3.1621    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0743   -2.4249    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.6210   -1.7356    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4446   -1.6877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2682   -1.6397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7215   -2.3290    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.1748   -3.0183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.5451   -2.2811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9984   -2.9704    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.8221   -2.9224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6282   -3.7076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8046   -3.7555    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.4343   -4.4928    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8876   -5.1821    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.7112   -5.1341    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1645   -5.8234    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.9881   -5.7755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7942   -6.5606    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.2476   -7.2499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9706   -6.6086    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.6003   -7.3458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5173   -5.9193    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.6937   -5.9672    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3512   -3.0662    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.9810   -3.8035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5276   -3.1142    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.8979   -2.3769    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1573   -3.8514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3337   -3.8994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8804   -3.2101    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4351   -3.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0648   -3.0857    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.3276   -2.7154    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3319   -3.4645    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2076   -4.2801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.4540   -3.6564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6399   -3.7902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1170   -3.1521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3030   -3.2858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4082   -2.3802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2223   -2.2464    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1155   -2.1473    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2  3  1  0  0  0  0
  4  3  1  0  0  0  0
  4  5  1  6  0  0  0
  6  4  1  0  0  0  0
  6  7  1  1  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
 10  9  1  0  0  0  0
 10 11  1  6  0  0  0
 10 12  1  0  0  0  0
 13 12  1  0  0  0  0
 13 14  1  1  0  0  0
 13 15  1  0  0  0  0
 16 15  1  0  0  0  0
 16 17  1  1  0  0  0
 18 17  1  6  0  0  0
 18 19  1  0  0  0  0
 20 19  1  0  0  0  0
 20 21  1  6  0  0  0
 22 20  1  0  0  0  0
 22 23  1  6  0  0  0
 22 24  1  0  0  0  0
 24 25  1  6  0  0  0
 24 26  1  0  0  0  0
 26 18  1  0  0  0  0
 26 27  1  1  0  0  0
 28 16  1  0  0  0  0
 28 10  1  0  0  0  0
 28 29  1  1  0  0  0
 28 30  1  0  0  0  0
 30  6  1  0  0  0  0
 30 31  1  6  0  0  0
 30 32  1  0  0  0  0
 32 33  1  0  0  0  0
 34 33  1  0  0  0  0
  4 34  1  0  0  0  0
 34 35  1  1  0  0  0
 34 36  1  0  0  0  0
 36  2  1  0  0  0  0
 36 37  1  6  0  0  0
 36 38  1  0  0  0  0
 38 39  1  6  0  0  0
 38 40  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 43 44  2  0  0  0  0
 43 45  1  0  0  0  0
 45 46  1  0  0  0  0
 40 46  1  0  0  0  0
 40 47  1  0  0  0  0
  2 47  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0352732

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@]12C[C@@]3([H])[C@]4([H])CC[C@@]5([H])C[C@@H](O)C[C@@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@H](C)C1(CCC(=C)CO1)O2

> <INCHI_IDENTIFIER>
InChI=1S/C33H52O8/c1-16-8-11-33(38-15-16)17(2)26-24(41-33)14-23-21-7-6-19-12-20(34)13-25(32(19,5)22(21)9-10-31(23,26)4)40-30-29(37)28(36)27(35)18(3)39-30/h17-30,34-37H,1,6-15H2,2-5H3/t17-,18+,19-,20+,21+,22-,23-,24-,25+,26-,27-,28-,29+,30-,31-,32-,33?/m0/s1

> <INCHI_KEY>
AQKYGCUTCZFIKF-IMPVNIAVSA-N

> <FORMULA>
C33H52O8

> <MOLECULAR_WEIGHT>
576.771

> <EXACT_MASS>
576.366218634

$$$$

HEADER    PROTEIN                                 16-MAR-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   16-MAR-23         0                                  
HETATM    1  H   UNK     0      14.555  -2.721   0.000  0.00  0.00           H+0
HETATM    2  C   UNK     0      14.805  -4.240   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      16.173  -3.533   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      17.268  -4.616   0.000  0.00  0.00           C+0
HETATM    5  H   UNK     0      18.114  -5.903   0.000  0.00  0.00           H+0
HETATM    6  C   UNK     0      18.805  -4.526   0.000  0.00  0.00           C+0
HETATM    7  H   UNK     0      17.959  -3.240   0.000  0.00  0.00           H+0
HETATM    8  C   UNK     0      19.497  -3.150   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      21.034  -3.061   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      21.880  -4.347   0.000  0.00  0.00           C+0
HETATM   11  H   UNK     0      22.726  -5.634   0.000  0.00  0.00           H+0
HETATM   12  C   UNK     0      23.418  -4.258   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      24.264  -5.545   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0      25.801  -5.455   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0      23.573  -6.921   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      22.035  -7.010   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      21.344  -8.386   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      22.190  -9.673   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0      23.728  -9.584   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0      24.574 -10.870   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      26.111 -10.781   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      23.883 -12.247   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      24.729 -13.533   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0      22.345 -12.336   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0      21.654 -13.712   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0      21.499 -11.049   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0      19.962 -11.139   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0      21.189  -5.724   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      20.498  -7.100   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      19.652  -5.813   0.000  0.00  0.00           C+0
HETATM   31  H   UNK     0      20.343  -4.437   0.000  0.00  0.00           H+0
HETATM   32  C   UNK     0      18.960  -7.189   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      17.423  -7.279   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      16.577  -5.992   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      15.746  -7.289   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      15.054  -5.760   0.000  0.00  0.00           C+0
HETATM   37  H   UNK     0      13.678  -5.069   0.000  0.00  0.00           H+0
HETATM   38  C   UNK     0      13.686  -6.467   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0      13.454  -7.989   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      12.591  -5.384   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0      12.048  -6.825   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0      10.528  -7.075   0.000  0.00  0.00           C+0
HETATM   43  C   UNK     0       9.552  -5.884   0.000  0.00  0.00           C+0
HETATM   44  C   UNK     0       8.032  -6.134   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0      10.095  -4.443   0.000  0.00  0.00           C+0
HETATM   46  O   UNK     0      11.615  -4.193   0.000  0.00  0.00           O+0
HETATM   47  O   UNK     0      13.282  -4.008   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   36   47                                             
CONECT    3    2    4                                                       
CONECT    4    3    5    6   34                                             
CONECT    5    4                                                            
CONECT    6    4    7    8   30                                             
CONECT    7    6                                                            
CONECT    8    6    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11   12   28                                             
CONECT   11   10                                                            
CONECT   12   10   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13   16                                                       
CONECT   16   15   17   28                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19   26                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22   25   26                                                  
CONECT   25   24                                                            
CONECT   26   24   18   27                                                  
CONECT   27   26                                                            
CONECT   28   16   10   29   30                                             
CONECT   29   28                                                            
CONECT   30   28    6   31   32                                             
CONECT   31   30                                                            
CONECT   32   30   33                                                       
CONECT   33   32   34                                                       
CONECT   34   33    4   35   36                                             
CONECT   35   34                                                            
CONECT   36   34    2   37   38                                             
CONECT   37   36                                                            
CONECT   38   36   39   40                                                  
CONECT   39   38                                                            
CONECT   40   38   41   46   47                                             
CONECT   41   40   42                                                       
CONECT   42   41   43                                                       
CONECT   43   42   44   45                                                  
CONECT   44   43                                                            
CONECT   45   43   46                                                       
CONECT   46   45   40                                                       
CONECT   47   40    2                                                       
MASTER        0    0    0    0    0    0    0    0   47    0  106    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₃₃H₅₂O₈

Average Mass

576.7710 Da

Monoisotopic Mass

576.36622 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

[H][C@]12C[C@@]3([H])[C@]4([H])CC[C@@]5([H])C[C@@H](O)C[C@@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@H](C)C1(CCC(=C)CO1)O2

InChI Identifier

InChI=1S/C33H52O8/c1-16-8-11-33(38-15-16)17(2)26-24(41-33)14-23-21-7-6-19-12-20(34)13-25(32(19,5)22(21)9-10-31(23,26)4)40-30-29(37)28(36)27(35)18(3)39-30/h17-30,34-37H,1,6-15H2,2-5H3/t17-,18+,19-,20+,21+,22-,23-,24-,25+,26-,27-,28-,29+,30-,31-,32-,33?/m0/s1

InChI Key

AQKYGCUTCZFIKF-IMPVNIAVSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Cordyline manners-suttoniae		Not Available

Chemical Taxonomy

Classification

Not classified

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

External Links

Not Available

References

General References

Showing NP-Card for Suttonigenin F (NP0352732)

MOL for NP0352732 (Suttonigenin F)

3D MOL for NP0352732 (Suttonigenin F)

3D SDF for NP0352732 (Suttonigenin F)

3D-SDF for NP0352732 (Suttonigenin F)

PDB for NP0352732 (Suttonigenin F)

3D PDB for NP0352732 (Suttonigenin F)

SMILES for NP0352732 (Suttonigenin F)

INCHI for NP0352732 (Suttonigenin F)

Structure for NP0352732 (Suttonigenin F)

3D Structure for NP0352732 (Suttonigenin F)