NP-MRD: Showing NP-Card for Otophylloside B 4'''-O-beta-D-oleandropyranoside (NP0140969)

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Record Information

Version

2.0

Created at

2022-06-29 22:01:00 UTC

Updated at

2022-06-29 22:01:01 UTC

NP-MRD ID

NP0140969

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Otophylloside B 4'''-O-beta-D-oleandropyranoside

Description

Otophylloside B 4'''-O-beta-D-oleandropyranoside belongs to the class of organic compounds known as steroidal glycosides. These are sterol lipids containing a carbohydrate moiety glycosidically linked to the steroid skeleton. Otophylloside B 4'''-O-beta-D-oleandropyranoside is found in Cynanchum caudatum. Based on a literature review very few articles have been published on Otophylloside B 4'''-O-beta-D-oleandropyranoside.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652306302200012D          

 75 82  0  0  1  0            999 V2000
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M  END

     RDKit          3D

165172  0  0  0  0  0  0  0  0999 V2000
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M  END


  Mrv1652306302200012D          

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   -5.7249    1.1409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7886    2.4023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9158    4.9251    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7280    4.7799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2916    5.2156    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  1  0  0  0
  9  8  1  6  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  9 14  1  0  0  0  0
 14 15  1  1  0  0  0
 15 16  1  0  0  0  0
 12 17  1  1  0  0  0
 18 17  1  6  0  0  0
 18 19  1  0  0  0  0
 19 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
 18 23  1  0  0  0  0
 23 24  1  6  0  0  0
 24 25  1  0  0  0  0
 21 26  1  1  0  0  0
 27 26  1  1  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 27 32  1  0  0  0  0
 32 33  1  1  0  0  0
 33 34  1  0  0  0  0
 30 35  1  6  0  0  0
 36 35  1  1  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 41  1  1  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 43 44  1  0  0  0  0
 44 45  1  0  0  0  0
 45 46  1  0  0  0  0
 46 47  1  0  0  0  0
 43 47  1  0  0  0  0
 47 48  1  0  0  0  0
 40 48  1  0  0  0  0
 48 49  1  0  0  0  0
 49 50  1  0  0  0  0
 50 51  2  0  0  0  0
 39 51  1  0  0  0  0
 51 52  1  0  0  0  0
 36 52  1  0  0  0  0
 48 53  1  1  0  0  0
 47 54  1  1  0  0  0
 44 55  1  6  0  0  0
 55 56  2  0  0  0  0
 55 57  1  0  0  0  0
 44 58  1  1  0  0  0
 43 59  1  1  0  0  0
 42 60  1  1  0  0  0
 60 61  1  0  0  0  0
 61 62  2  0  0  0  0
 61 63  1  0  0  0  0
 63 64  2  0  0  0  0
 64 65  1  0  0  0  0
 64 66  1  0  0  0  0
 66 67  1  0  0  0  0
 66 68  1  0  0  0  0
 39 69  1  1  0  0  0
 28 70  1  6  0  0  0
 19 71  1  1  0  0  0
 10 72  1  1  0  0  0
  4 73  1  1  0  0  0
 73 74  1  0  0  0  0
  3 75  1  6  0  0  0
M  END
> <DATABASE_ID>
NP0140969

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CO[C@@H]1C[C@H](O[C@@H]2[C@@H](C)O[C@H](C[C@H]2OC)O[C@@H]2[C@@H](C)O[C@H](C[C@@H]2OC)O[C@@H]2[C@@H](C)O[C@H](C[C@@H]2OC)O[C@H]2CC[C@]3(C)[C@H]4C[C@@H](OC(=O)\C=C(/C)C(C)C)[C@]5(C)[C@@](O)(CC[C@]5(O)[C@]4(O)CC=C3C2)C(C)=O)O[C@H](C)[C@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C56H90O19/c1-28(2)29(3)21-43(58)72-42-27-41-52(9)17-16-36(22-35(52)15-18-55(41,61)56(62)20-19-54(60,34(8)57)53(42,56)10)71-44-24-38(64-12)49(31(5)68-44)74-46-26-40(66-14)51(33(7)70-46)75-47-25-39(65-13)50(32(6)69-47)73-45-23-37(63-11)48(59)30(4)67-45/h15,21,28,30-33,36-42,44-51,59-62H,16-20,22-27H2,1-14H3/b29-21+/t30-,31-,32-,33-,36+,37-,38+,39-,40+,41-,42-,44+,45+,46+,47+,48-,49-,50-,51-,52+,53-,54-,55+,56-/m1/s1

> <INCHI_KEY>
YUDOHRCAEPBFBO-VWBWVSKCSA-N

> <FORMULA>
C56H90O19

> <MOLECULAR_WEIGHT>
1067.317

> <EXACT_MASS>
1066.607630678

$$$$

HEADER    PROTEIN                                 30-JUN-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   30-JUN-22         0                                  
HETATM    1  C   UNK     0     -11.626   7.381   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0     -13.141   7.110   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0     -14.134   8.287   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0     -15.650   8.016   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0     -16.173   6.568   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0     -15.181   5.391   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0     -13.665   5.662   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0     -15.704   3.942   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0     -14.711   2.765   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0     -13.195   3.036   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0     -12.202   1.859   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0     -12.726   0.410   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0     -14.242   0.139   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0     -15.234   1.316   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0     -16.750   1.045   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0     -17.743   2.223   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0     -11.733  -0.767   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0     -10.217  -0.496   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -9.694   0.952   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      -8.178   1.223   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0      -7.185   0.046   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -7.708  -1.402   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -9.224  -1.673   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      -9.748  -3.122   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0     -11.263  -3.393   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      -5.669   0.317   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      -4.676  -0.860   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -5.200  -2.309   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0      -4.207  -3.486   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0      -2.691  -3.215   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      -2.168  -1.766   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      -3.160  -0.589   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0      -2.637   0.859   0.000  0.00  0.00           O+0
HETATM   34  C   UNK     0      -3.630   2.037   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0      -1.698  -4.392   0.000  0.00  0.00           O+0
HETATM   36  C   UNK     0      -0.182  -4.121   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0       0.341  -2.673   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0       1.857  -2.402   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0       2.850  -3.579   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       4.366  -3.308   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       4.889  -1.859   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0       6.405  -1.588   0.000  0.00  0.00           C+0
HETATM   43  C   UNK     0       7.398  -2.766   0.000  0.00  0.00           C+0
HETATM   44  C   UNK     0       8.937  -2.816   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0       9.365  -4.295   0.000  0.00  0.00           C+0
HETATM   46  C   UNK     0       8.090  -5.159   0.000  0.00  0.00           C+0
HETATM   47  C   UNK     0       6.874  -4.214   0.000  0.00  0.00           C+0
HETATM   48  C   UNK     0       5.358  -4.485   0.000  0.00  0.00           C+0
HETATM   49  C   UNK     0       4.835  -5.934   0.000  0.00  0.00           C+0
HETATM   50  C   UNK     0       3.319  -6.205   0.000  0.00  0.00           C+0
HETATM   51  C   UNK     0       2.326  -5.027   0.000  0.00  0.00           C+0
HETATM   52  C   UNK     0       0.810  -5.298   0.000  0.00  0.00           C+0
HETATM   53  O   UNK     0       6.351  -5.663   0.000  0.00  0.00           O+0
HETATM   54  O   UNK     0       6.985  -5.750   0.000  0.00  0.00           O+0
HETATM   55  C   UNK     0      10.357  -2.221   0.000  0.00  0.00           C+0
HETATM   56  O   UNK     0      10.552  -0.693   0.000  0.00  0.00           O+0
HETATM   57  C   UNK     0      11.583  -3.153   0.000  0.00  0.00           C+0
HETATM   58  O   UNK     0       9.163  -1.293   0.000  0.00  0.00           O+0
HETATM   59  C   UNK     0       8.069  -1.380   0.000  0.00  0.00           C+0
HETATM   60  O   UNK     0       6.928  -0.140   0.000  0.00  0.00           O+0
HETATM   61  C   UNK     0       5.935   1.037   0.000  0.00  0.00           C+0
HETATM   62  O   UNK     0       4.419   0.766   0.000  0.00  0.00           O+0
HETATM   63  C   UNK     0       6.458   2.486   0.000  0.00  0.00           C+0
HETATM   64  C   UNK     0       5.466   3.663   0.000  0.00  0.00           C+0
HETATM   65  C   UNK     0       3.950   3.392   0.000  0.00  0.00           C+0
HETATM   66  C   UNK     0       5.989   5.111   0.000  0.00  0.00           C+0
HETATM   67  C   UNK     0       7.505   5.382   0.000  0.00  0.00           C+0
HETATM   68  C   UNK     0       4.996   6.289   0.000  0.00  0.00           C+0
HETATM   69  C   UNK     0       3.373  -2.131   0.000  0.00  0.00           C+0
HETATM   70  C   UNK     0      -6.716  -2.580   0.000  0.00  0.00           C+0
HETATM   71  C   UNK     0     -10.687   2.130   0.000  0.00  0.00           C+0
HETATM   72  C   UNK     0     -12.672   4.484   0.000  0.00  0.00           C+0
HETATM   73  O   UNK     0     -16.643   9.194   0.000  0.00  0.00           O+0
HETATM   74  C   UNK     0     -18.159   8.923   0.000  0.00  0.00           C+0
HETATM   75  O   UNK     0     -13.611   9.736   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    7                                                  
CONECT    3    2    4   75                                                  
CONECT    4    3    5   73                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7    8                                                  
CONECT    7    6    2                                                       
CONECT    8    6    9                                                       
CONECT    9    8   10   14                                                  
CONECT   10    9   11   72                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13   17                                                  
CONECT   13   12   14                                                       
CONECT   14   13    9   15                                                  
CONECT   15   14   16                                                       
CONECT   16   15                                                            
CONECT   17   12   18                                                       
CONECT   18   17   19   23                                                  
CONECT   19   18   20   71                                                  
CONECT   20   19   21                                                       
CONECT   21   20   22   26                                                  
CONECT   22   21   23                                                       
CONECT   23   22   18   24                                                  
CONECT   24   23   25                                                       
CONECT   25   24                                                            
CONECT   26   21   27                                                       
CONECT   27   26   28   32                                                  
CONECT   28   27   29   70                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31   35                                                  
CONECT   31   30   32                                                       
CONECT   32   31   27   33                                                  
CONECT   33   32   34                                                       
CONECT   34   33                                                            
CONECT   35   30   36                                                       
CONECT   36   35   37   52                                                  
CONECT   37   36   38                                                       
CONECT   38   37   39                                                       
CONECT   39   38   40   51   69                                             
CONECT   40   39   41   48                                                  
CONECT   41   40   42                                                       
CONECT   42   41   43   60                                                  
CONECT   43   42   44   47   59                                             
CONECT   44   43   45   55   58                                             
CONECT   45   44   46                                                       
CONECT   46   45   47                                                       
CONECT   47   46   43   48   54                                             
CONECT   48   47   40   49   53                                             
CONECT   49   48   50                                                       
CONECT   50   49   51                                                       
CONECT   51   50   39   52                                                  
CONECT   52   51   36                                                       
CONECT   53   48                                                            
CONECT   54   47                                                            
CONECT   55   44   56   57                                                  
CONECT   56   55                                                            
CONECT   57   55                                                            
CONECT   58   44                                                            
CONECT   59   43                                                            
CONECT   60   42   61                                                       
CONECT   61   60   62   63                                                  
CONECT   62   61                                                            
CONECT   63   61   64                                                       
CONECT   64   63   65   66                                                  
CONECT   65   64                                                            
CONECT   66   64   67   68                                                  
CONECT   67   66                                                            
CONECT   68   66                                                            
CONECT   69   39                                                            
CONECT   70   28                                                            
CONECT   71   19                                                            
CONECT   72   10                                                            
CONECT   73    4   74                                                       
CONECT   74   73                                                            
CONECT   75    3                                                            
MASTER        0    0    0    0    0    0    0    0   75    0  164    0
END

View in JSmol

Synonyms

Value	Source
Otophylloside b 4'''-O-b-D-oleandropyranoside	Generator
Otophylloside b 4'''-O-β-D-oleandropyranoside	Generator

Chemical Formula

C₅₆H₉₀O₁₉

Average Mass

1067.3170 Da

Monoisotopic Mass

1066.60763 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

CO[C@@H]1C[C@H](O[C@@H]2[C@@H](C)O[C@H](C[C@H]2OC)O[C@@H]2[C@@H](C)O[C@H](C[C@@H]2OC)O[C@@H]2[C@@H](C)O[C@H](C[C@@H]2OC)O[C@H]2CC[C@]3(C)[C@H]4C[C@@H](OC(=O)\C=C(/C)C(C)C)[C@]5(C)[C@@](O)(CC[C@]5(O)[C@]4(O)CC=C3C2)C(C)=O)O[C@H](C)[C@H]1O

InChI Identifier

InChI=1S/C56H90O19/c1-28(2)29(3)21-43(58)72-42-27-41-52(9)17-16-36(22-35(52)15-18-55(41,61)56(62)20-19-54(60,34(8)57)53(42,56)10)71-44-24-38(64-12)49(31(5)68-44)74-46-26-40(66-14)51(33(7)70-46)75-47-25-39(65-13)50(32(6)69-47)73-45-23-37(63-11)48(59)30(4)67-45/h15,21,28,30-33,36-42,44-51,59-62H,16-20,22-27H2,1-14H3/b29-21+/t30-,31-,32-,33-,36+,37-,38+,39-,40+,41-,42-,44+,45+,46+,47+,48-,49-,50-,51-,52+,53-,54-,55+,56-/m1/s1

InChI Key

YUDOHRCAEPBFBO-VWBWVSKCSA-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, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, 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
Cynanchum caudatum	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as steroidal glycosides. These are sterol lipids containing a carbohydrate moiety glycosidically linked to the steroid skeleton.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Sub Class

Steroidal glycosides

Direct Parent

Steroidal glycosides

Alternative Parents

Substituents

Steroidal glycoside
Oligosaccharide
20-oxosteroid
Steroid ester
Pregnane-skeleton
17-hydroxysteroid
14-hydroxysteroid
Oxosteroid
Hydroxysteroid
Delta-5-steroid
O-glycosyl compound
Glycosyl compound
Oxane
Alpha,beta-unsaturated carboxylic ester
Enoate ester
Alpha-hydroxy ketone
Tertiary alcohol
Cyclic alcohol
Carboxylic acid ester
Secondary alcohol
Ketone
Acetal
Carboxylic acid derivative
Oxacycle
Dialkyl ether
Ether
Organoheterocyclic compound
Polyol
Monocarboxylic acid or derivatives
Organic oxygen compound
Carbonyl group
Alcohol
Organic oxide
Organooxygen compound
Hydrocarbon derivative
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic heteropolycyclic 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

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

8526609

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

10351157

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Otophylloside B 4'''-O-beta-D-oleandropyranoside (NP0140969)

MOL for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

3D MOL for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

3D SDF for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

3D-SDF for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

PDB for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

3D PDB for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

SMILES for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

INCHI for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

Structure for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)

3D Structure for NP0140969 (Otophylloside B 4'''-O-beta-D-oleandropyranoside)