NP-MRD: Showing NP-Card for Nagelamide H (NP0079216)

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Record Information

Version

2.0

Created at

2022-04-29 00:15:29 UTC

Updated at

2022-04-29 00:15:30 UTC

NP-MRD ID

NP0079216

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Nagelamide H

Description

2-{[(5R)-5-{5-[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-2-imino-2,3-dihydro-1H-imidazol-4-yl}-5-{3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl}-2-iminoimidazolidin-4-ylidene]amino}ethane-1-sulfonic acid belongs to the class of organic compounds known as 2-heteroaryl carboxamides. 2-Heteroaryl carboxamides are compounds containing a heteroaromatic ring that carries a carboxamide group. Nagelamide H is found in Agelas sp. Based on a literature review very few articles have been published on 2-{[(5R)-5-{5-[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-2-imino-2,3-dihydro-1H-imidazol-4-yl}-5-{3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl}-2-iminoimidazolidin-4-ylidene]amino}ethane-1-sulfonic acid.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652304292202152D          

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M  END

     RDKit          3D

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M  END


  Mrv1652304292202152D          

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    0.9831   -5.3352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0134   -0.6713    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6568   -1.7425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3713   -1.3300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3713   -0.5050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0857   -0.0925    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0857    0.7325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3713    1.1450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8002    1.1450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8865    1.9655    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6934    2.1370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1059    1.4225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5539    0.8094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9264    1.3363    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    8.0290    2.8907    0.0000 Br  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  1  0  0  0  0
  4  5  2  0  0  0  0
  1  5  1  0  0  0  0
  4  6  1  0  0  0  0
  7  2  1  6  0  0  0
  7  8  1  1  0  0  0
  8  9  2  0  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  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 14 18  2  0  0  0  0
 17 19  1  0  0  0  0
 16 20  1  0  0  0  0
  7 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
  7 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  2  0  0  0  0
 28 31  1  0  0  0  0
 22 32  1  0  0  0  0
  1 33  1  0  0  0  0
 33 34  2  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  2  0  0  0  0
 42 43  1  0  0  0  0
 39 43  2  0  0  0  0
 42 44  1  0  0  0  0
 41 45  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0079216

> <DATABASE_NAME>
NP-MRD

> <SMILES>
NC1=NC(\C=C\CNC(=O)C2=CC(Br)=C(Br)N2)=C(N1)[C@@]1(\C=C\CNC(=O)C2=CC(Br)=C(Br)N2)N=C(N)N=C1NCCS(O)(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C24H25Br4N11O5S/c25-11-9-14(34-17(11)27)19(40)31-5-1-3-13-16(37-22(29)36-13)24(21(38-23(30)39-24)33-7-8-45(42,43)44)4-2-6-32-20(41)15-10-12(26)18(28)35-15/h1-4,9-10,34-35H,5-8H2,(H,31,40)(H,32,41)(H3,29,36,37)(H,42,43,44)(H3,30,33,38,39)/b3-1+,4-2+/t24-/m1/s1

> <INCHI_KEY>
YKINYXUSZLKEHU-LNCKGOFISA-N

> <FORMULA>
C24H25Br4N11O5S

> <MOLECULAR_WEIGHT>
899.21

> <EXACT_MASS>
894.849436

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_ATOM_COUNT>
70

> <JCHEM_AVERAGE_POLARIZABILITY>
73.1759000884863

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-{[(4R)-2,2'-diamino-4,5'-bis[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-3'H,4H-[4,4'-biimidazole]-5-yl]amino}ethane-1-sulfonic acid

> <ALOGPS_LOGP>
2.85

> <JCHEM_LOGP>
0.11951097814954471

> <ALOGPS_LOGS>
-5.27

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
11.30939480406686

> <JCHEM_PKA_STRONGEST_ACIDIC>
-8.017438916569585

> <JCHEM_PKA_STRONGEST_BASIC>
8.767112014855615

> <JCHEM_POLAR_SURFACE_AREA>
261.62

> <JCHEM_REFRACTIVITY>
182.36369999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
12

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
4.84e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-{[(4R)-2,2'-diamino-4,5'-bis[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-3'H-[4,4'-biimidazole]-5-yl]amino}ethanesulfonic acid

> <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  C   UNK     0       8.693  -4.793   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       7.447  -5.698   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0       7.923  -7.162   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0       9.463  -7.162   0.000  0.00  0.00           C+0
HETATM    5  N   UNK     0       9.939  -5.698   0.000  0.00  0.00           N+0
HETATM    6  N   UNK     0      10.368  -8.408   0.000  0.00  0.00           N+0
HETATM    7  C   UNK     0       5.982  -5.222   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       5.662  -6.728   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       4.197  -7.204   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       3.877  -8.711   0.000  0.00  0.00           C+0
HETATM   11  N   UNK     0       5.022  -9.741   0.000  0.00  0.00           N+0
HETATM   12  C   UNK     0       6.486  -9.265   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       6.806  -7.759   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       7.631 -10.296   0.000  0.00  0.00           C+0
HETATM   15  N   UNK     0       9.137  -9.975   0.000  0.00  0.00           N+0
HETATM   16  C   UNK     0       9.907 -11.309   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       8.877 -12.454   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       7.470 -11.827   0.000  0.00  0.00           C+0
HETATM   19 Br   UNK     0       9.197 -13.960   0.000  0.00  0.00          Br+0
HETATM   20 Br   UNK     0      11.439 -11.470   0.000  0.00  0.00          Br+0
HETATM   21  N   UNK     0       6.609  -3.815   0.000  0.00  0.00           N+0
HETATM   22  C   UNK     0       5.464  -2.785   0.000  0.00  0.00           C+0
HETATM   23  N   UNK     0       4.130  -3.555   0.000  0.00  0.00           N+0
HETATM   24  C   UNK     0       4.451  -5.061   0.000  0.00  0.00           C+0
HETATM   25  N   UNK     0       3.420  -6.205   0.000  0.00  0.00           N+0
HETATM   26  C   UNK     0       1.914  -5.885   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       0.883  -7.030   0.000  0.00  0.00           C+0
HETATM   28  S   UNK     0       1.359  -8.494   0.000  0.00  0.00           S+0
HETATM   29  O   UNK     0       2.824  -8.018   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0      -0.105  -8.970   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       1.835  -9.959   0.000  0.00  0.00           O+0
HETATM   32  N   UNK     0       5.625  -1.253   0.000  0.00  0.00           N+0
HETATM   33  C   UNK     0       8.693  -3.253   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      10.026  -2.483   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      10.026  -0.943   0.000  0.00  0.00           C+0
HETATM   36  N   UNK     0      11.360  -0.173   0.000  0.00  0.00           N+0
HETATM   37  C   UNK     0      11.360   1.367   0.000  0.00  0.00           C+0
HETATM   38  O   UNK     0      10.026   2.137   0.000  0.00  0.00           O+0
HETATM   39  C   UNK     0      12.694   2.137   0.000  0.00  0.00           C+0
HETATM   40  N   UNK     0      12.855   3.669   0.000  0.00  0.00           N+0
HETATM   41  C   UNK     0      14.361   3.989   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0      15.131   2.655   0.000  0.00  0.00           C+0
HETATM   43  C   UNK     0      14.101   1.511   0.000  0.00  0.00           C+0
HETATM   44 Br   UNK     0      16.663   2.494   0.000  0.00  0.00          Br+0
HETATM   45 Br   UNK     0      14.987   5.396   0.000  0.00  0.00          Br+0
CONECT    1    2    5   33                                                  
CONECT    2    1    3    7                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    6                                                  
CONECT    5    4    1                                                       
CONECT    6    4                                                            
CONECT    7    2    8   21   24                                             
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15   18                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   20                                                  
CONECT   17   16   18   19                                                  
CONECT   18   17   14                                                       
CONECT   19   17                                                            
CONECT   20   16                                                            
CONECT   21    7   22                                                       
CONECT   22   21   23   32                                                  
CONECT   23   22   24                                                       
CONECT   24   23    7   25                                                  
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26   28                                                       
CONECT   28   27   29   30   31                                             
CONECT   29   28                                                            
CONECT   30   28                                                            
CONECT   31   28                                                            
CONECT   32   22                                                            
CONECT   33    1   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   43                                                  
CONECT   40   39   41                                                       
CONECT   41   40   42   45                                                  
CONECT   42   41   43   44                                                  
CONECT   43   42   39                                                       
CONECT   44   42                                                            
CONECT   45   41                                                            
MASTER        0    0    0    0    0    0    0    0   45    0   96    0
END

View in JSmol

Synonyms

Value	Source
2-{[(5R)-5-{5-[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-2-imino-2,3-dihydro-1H-imidazol-4-yl}-5-{3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl}-2-iminoimidazolidin-4-ylidene]amino}ethane-1-sulfonate	Generator
2-{[(5R)-5-{5-[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-2-imino-2,3-dihydro-1H-imidazol-4-yl}-5-{3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl}-2-iminoimidazolidin-4-ylidene]amino}ethane-1-sulphonate	Generator
2-{[(5R)-5-{5-[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-2-imino-2,3-dihydro-1H-imidazol-4-yl}-5-{3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl}-2-iminoimidazolidin-4-ylidene]amino}ethane-1-sulphonic acid	Generator

Chemical Formula

C₂₄H₂₅Br₄N₁₁O₅S

Average Mass

899.2100 Da

Monoisotopic Mass

894.84944 Da

IUPAC Name

2-{[(4R)-2,2'-diamino-4,5'-bis[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-3'H,4H-[4,4'-biimidazole]-5-yl]amino}ethane-1-sulfonic acid

Traditional Name

2-{[(4R)-2,2'-diamino-4,5'-bis[(1E)-3-[(4,5-dibromo-1H-pyrrol-2-yl)formamido]prop-1-en-1-yl]-3'H-[4,4'-biimidazole]-5-yl]amino}ethanesulfonic acid

CAS Registry Number

Not Available

SMILES

NC1=NC(\C=C\CNC(=O)C2=CC(Br)=C(Br)N2)=C(N1)[C@@]1(\C=C\CNC(=O)C2=CC(Br)=C(Br)N2)N=C(N)N=C1NCCS(O)(=O)=O

InChI Identifier

InChI=1S/C24H25Br4N11O5S/c25-11-9-14(34-17(11)27)19(40)31-5-1-3-13-16(37-22(29)36-13)24(21(38-23(30)39-24)33-7-8-45(42,43)44)4-2-6-32-20(41)15-10-12(26)18(28)35-15/h1-4,9-10,34-35H,5-8H2,(H,31,40)(H,32,41)(H3,29,36,37)(H,42,43,44)(H3,30,33,38,39)/b3-1+,4-2+/t24-/m1/s1

InChI Key

YKINYXUSZLKEHU-LNCKGOFISA-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
Agelas sp.	Animalia	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as 2-heteroaryl carboxamides. 2-Heteroaryl carboxamides are compounds containing a heteroaromatic ring that carries a carboxamide group.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Carboxylic acid derivatives

Direct Parent

2-heteroaryl carboxamides

Alternative Parents

Substituents

2-heteroaryl carboxamide
Pyrrole-2-carboxylic acid or derivatives
Pyrrole-2-carboxamide
Imidolactam
Substituted pyrrole
Aryl halide
Aryl bromide
Heteroaromatic compound
Alkanesulfonic acid
Sulfonyl
Organosulfonic acid
Organosulfonic acid or derivatives
Organic sulfonic acid or derivatives
Pyrrole
Imidazolidine
Imidazole
Azole
Secondary carboxylic acid amide
Guanidine
Azacycle
Organoheterocyclic compound
Organic 1,3-dipolar compound
Propargyl-type 1,3-dipolar organic compound
Carboximidamide
Carboxylic acid amidine
Amidine
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Organosulfur compound
Organooxygen compound
Organonitrogen compound
Organobromide
Organohalogen compound
Imine
Aromatic heteromonocyclic compound

Molecular Framework

Aromatic heteromonocyclic 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	2.85	ALOGPS
logP	0.12	ChemAxon
logS	-5.3	ALOGPS
pKa (Strongest Acidic)	-8	ChemAxon
pKa (Strongest Basic)	8.77	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	11	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	261.62 Å²	ChemAxon
Rotatable Bond Count	12	ChemAxon
Refractivity	182.36 m³·mol⁻¹	ChemAxon
Polarizability	73.18 Å³	ChemAxon
Number of Rings	4	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

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

162862370

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Nagelamide H (NP0079216)

MOL for NP0079216 (Nagelamide H)

3D MOL for NP0079216 (Nagelamide H)

3D SDF for NP0079216 (Nagelamide H)

3D-SDF for NP0079216 (Nagelamide H)

PDB for NP0079216 (Nagelamide H)

3D PDB for NP0079216 (Nagelamide H)

SMILES for NP0079216 (Nagelamide H)

INCHI for NP0079216 (Nagelamide H)

Structure for NP0079216 (Nagelamide H)

3D Structure for NP0079216 (Nagelamide H)