NP-MRD: Showing NP-Card for Nephilatoxin 643 (NP0068559)

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Record Information

Version

2.0

Created at

2022-04-28 13:49:26 UTC

Updated at

2022-04-28 13:49:26 UTC

NP-MRD ID

NP0068559

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Nephilatoxin 643

Description

NPTX-643 belongs to the class of organic compounds known as asparagine and derivatives. Asparagine and derivatives are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Nephilatoxin 643 is found in Nephilengys borbonica. Based on a literature review very few articles have been published on NPTX-643.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652304282215492D          

 46 47  0  0  1  0            999 V2000
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M  END

     RDKit          3D

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M  END


  Mrv1652304282215492D          

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   -3.2077    4.1208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6556    4.7339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8487    4.5624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5937    3.7777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1457    3.1647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9527    3.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7332    2.4502    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9263    2.6217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8400    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1256    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5889    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5889    2.6172    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3034    3.8547    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0178    3.4422    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.0178    2.6172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7323    2.2047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4468    2.6172    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7323    1.3797    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7323    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7323    4.6797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4468    3.4422    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1613    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8757    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5902    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3047    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0191    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7336    3.4422    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4481    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4481    4.6797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1626    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8770    3.8547    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.5915    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3060    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0204    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7349    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4494    3.4422    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1639    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1639    4.6797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8783    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5928    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3073    3.4422    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.0217    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7362    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4507    3.8547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1651    3.4422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8796    3.8547    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  4  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 14 13  1  6  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 14 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 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  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 28 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  2  0  0  0  0
 37 39  1  0  0  0  0
 39 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  1  0  0  0  0
 44 45  1  0  0  0  0
 45 46  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0068559

> <DATABASE_NAME>
NP-MRD

> <SMILES>
NCCCCNCCC(=O)NCCCCNCC(=O)NCCCCCNC(=O)[C@H](CC(N)=O)NC(=O)CC1=CNC2=CC=CC=C12

> <INCHI_IDENTIFIER>
InChI=1S/C32H53N9O5/c33-13-4-7-14-35-19-12-29(43)37-17-9-8-15-36-23-31(45)38-16-5-1-6-18-39-32(46)27(21-28(34)42)41-30(44)20-24-22-40-26-11-3-2-10-25(24)26/h2-3,10-11,22,27,35-36,40H,1,4-9,12-21,23,33H2,(H2,34,42)(H,37,43)(H,38,45)(H,39,46)(H,41,44)/t27-/m0/s1

> <INCHI_KEY>
BIAAMRCPEFOYIT-MHZLTWQESA-N

> <FORMULA>
C32H53N9O5

> <MOLECULAR_WEIGHT>
643.834

> <EXACT_MASS>
643.416965843

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
99

> <JCHEM_AVERAGE_POLARIZABILITY>
73.13724941902527

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S)-N-(5-{2-[(4-{3-[(4-aminobutyl)amino]propanamido}butyl)amino]acetamido}pentyl)-2-[2-(1H-indol-3-yl)acetamido]butanediamide

> <ALOGPS_LOGP>
0.51

> <JCHEM_LOGP>
-2.1815924573333345

> <ALOGPS_LOGS>
-4.54

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
3

> <JCHEM_PKA>
15.058988756330429

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.710934593389243

> <JCHEM_PKA_STRONGEST_BASIC>
10.38142425925388

> <JCHEM_POLAR_SURFACE_AREA>
225.36

> <JCHEM_REFRACTIVITY>
177.162

> <JCHEM_ROTATABLE_BOND_COUNT>
26

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.84e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2S)-N-(5-{2-[(4-{3-[(4-aminobutyl)amino]propanamido}butyl)amino]acetamido}pentyl)-2-[2-(1H-indol-3-yl)acetamido]succinamide

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 28-APR-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   28-APR-22         0                                  
HETATM    1  C   UNK     0      -5.988   7.692   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -4.957   8.837   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -3.451   8.516   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -2.975   7.052   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -4.005   5.907   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -5.512   6.228   0.000  0.00  0.00           C+0
HETATM    7  N   UNK     0      -3.235   4.574   0.000  0.00  0.00           N+0
HETATM    8  C   UNK     0      -1.729   4.894   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -1.568   6.425   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -0.234   7.195   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       1.099   6.425   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       1.099   4.885   0.000  0.00  0.00           O+0
HETATM   13  N   UNK     0       2.433   7.195   0.000  0.00  0.00           N+0
HETATM   14  C   UNK     0       3.767   6.425   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       3.767   4.885   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       5.100   4.115   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       6.434   4.885   0.000  0.00  0.00           O+0
HETATM   18  N   UNK     0       5.100   2.575   0.000  0.00  0.00           N+0
HETATM   19  C   UNK     0       5.100   7.195   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       5.100   8.735   0.000  0.00  0.00           O+0
HETATM   21  N   UNK     0       6.434   6.425   0.000  0.00  0.00           N+0
HETATM   22  C   UNK     0       7.768   7.195   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       9.101   6.425   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      10.435   7.195   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      11.769   6.425   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      13.102   7.195   0.000  0.00  0.00           C+0
HETATM   27  N   UNK     0      14.436   6.425   0.000  0.00  0.00           N+0
HETATM   28  C   UNK     0      15.770   7.195   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0      15.770   8.735   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0      17.103   6.425   0.000  0.00  0.00           C+0
HETATM   31  N   UNK     0      18.437   7.195   0.000  0.00  0.00           N+0
HETATM   32  C   UNK     0      19.771   6.425   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      21.104   7.195   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      22.438   6.425   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      23.772   7.195   0.000  0.00  0.00           C+0
HETATM   36  N   UNK     0      25.106   6.425   0.000  0.00  0.00           N+0
HETATM   37  C   UNK     0      26.439   7.195   0.000  0.00  0.00           C+0
HETATM   38  O   UNK     0      26.439   8.735   0.000  0.00  0.00           O+0
HETATM   39  C   UNK     0      27.773   6.425   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      29.107   7.195   0.000  0.00  0.00           C+0
HETATM   41  N   UNK     0      30.440   6.425   0.000  0.00  0.00           N+0
HETATM   42  C   UNK     0      31.774   7.195   0.000  0.00  0.00           C+0
HETATM   43  C   UNK     0      33.108   6.425   0.000  0.00  0.00           C+0
HETATM   44  C   UNK     0      34.441   7.195   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0      35.775   6.425   0.000  0.00  0.00           C+0
HETATM   46  N   UNK     0      37.109   7.195   0.000  0.00  0.00           N+0
CONECT    1    2    6                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5    9                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5    1                                                       
CONECT    7    5    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8    4   10                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12   13                                                  
CONECT   12   11                                                            
CONECT   13   11   14                                                       
CONECT   14   13   15   19                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16                                                            
CONECT   19   14   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22                                                       
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26   28                                                       
CONECT   28   27   29   30                                                  
CONECT   29   28                                                            
CONECT   30   28   31                                                       
CONECT   31   30   32                                                       
CONECT   32   31   33                                                       
CONECT   33   32   34                                                       
CONECT   34   33   35                                                       
CONECT   35   34   36                                                       
CONECT   36   35   37                                                       
CONECT   37   36   38   39                                                  
CONECT   38   37                                                            
CONECT   39   37   40                                                       
CONECT   40   39   41                                                       
CONECT   41   40   42                                                       
CONECT   42   41   43                                                       
CONECT   43   42   44                                                       
CONECT   44   43   45                                                       
CONECT   45   44   46                                                       
CONECT   46   45                                                            
MASTER        0    0    0    0    0    0    0    0   46    0   94    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₃₂H₅₃N₉O₅

Average Mass

643.8340 Da

Monoisotopic Mass

643.41697 Da

IUPAC Name

(2S)-N-(5-{2-[(4-{3-[(4-aminobutyl)amino]propanamido}butyl)amino]acetamido}pentyl)-2-[2-(1H-indol-3-yl)acetamido]butanediamide

Traditional Name

(2S)-N-(5-{2-[(4-{3-[(4-aminobutyl)amino]propanamido}butyl)amino]acetamido}pentyl)-2-[2-(1H-indol-3-yl)acetamido]succinamide

CAS Registry Number

Not Available

SMILES

NCCCCNCCC(=O)NCCCCNCC(=O)NCCCCCNC(=O)[C@H](CC(N)=O)NC(=O)CC1=CNC2=CC=CC=C12

InChI Identifier

InChI=1S/C32H53N9O5/c33-13-4-7-14-35-19-12-29(43)37-17-9-8-15-36-23-31(45)38-16-5-1-6-18-39-32(46)27(21-28(34)42)41-30(44)20-24-22-40-26-11-3-2-10-25(24)26/h2-3,10-11,22,27,35-36,40H,1,4-9,12-21,23,33H2,(H2,34,42)(H,37,43)(H,38,45)(H,39,46)(H,41,44)/t27-/m0/s1

InChI Key

BIAAMRCPEFOYIT-MHZLTWQESA-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
Nephilengys borbonica	Animalia	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as asparagine and derivatives. Asparagine and derivatives are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Asparagine and derivatives

Alternative Parents

Substituents

Asparagine or derivatives
N-acyl-alpha amino acid or derivatives
Alpha-amino acid amide
Beta amino acid or derivatives
3-alkylindole
Indole
Indole or derivatives
Fatty amide
N-acyl-amine
Substituted pyrrole
Benzenoid
Fatty acyl
Pyrrole
Heteroaromatic compound
Secondary carboxylic acid amide
Primary carboxylic acid amide
Carboxamide group
Secondary amine
Organoheterocyclic compound
Azacycle
Secondary aliphatic amine
Carbonyl group
Primary aliphatic amine
Hydrocarbon derivative
Organic oxide
Organic nitrogen compound
Amine
Organonitrogen compound
Organooxygen compound
Organic oxygen compound
Primary amine
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic 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
logP	0.51	ALOGPS
logP	-2.2	ChemAxon
logS	-4.5	ALOGPS
pKa (Strongest Acidic)	12.71	ChemAxon
pKa (Strongest Basic)	10.38	ChemAxon
Physiological Charge	3	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	225.36 Å²	ChemAxon
Rotatable Bond Count	26	ChemAxon
Refractivity	177.16 m³·mol⁻¹	ChemAxon
Polarizability	73.14 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00026525

Chemspider ID

9257943

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

11082796

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Nephilatoxin 643 (NP0068559)

MOL for NP0068559 (Nephilatoxin 643)

3D MOL for NP0068559 (Nephilatoxin 643)

3D SDF for NP0068559 (Nephilatoxin 643)

3D-SDF for NP0068559 (Nephilatoxin 643)

PDB for NP0068559 (Nephilatoxin 643)

3D PDB for NP0068559 (Nephilatoxin 643)

SMILES for NP0068559 (Nephilatoxin 643)

INCHI for NP0068559 (Nephilatoxin 643)

Structure for NP0068559 (Nephilatoxin 643)

3D Structure for NP0068559 (Nephilatoxin 643)