NP-MRD: Showing NP-Card for (-)-seco[D-Asp3]microcystin-RR (NP0079300)

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Record Information

Version

2.0

Created at

2022-04-29 00:19:57 UTC

Updated at

2022-04-29 00:19:57 UTC

NP-MRD ID

NP0079300

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(-)-seco[D-Asp3]microcystin-RR

Description

CHEMBL502303 belongs to the class of organic compounds known as hybrid peptides. Hybrid peptides are compounds containing at least two different types of amino acids (alpha, beta, gamma, delta) linked to each other through a peptide bond. (-)-seco[D-Asp3]microcystin-RR is found in Planktothrix rubescens. Based on a literature review very few articles have been published on CHEMBL502303.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652304292202192D          

 74 74  0  0  1  0            999 V2000
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M  END

     RDKit          3D

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M  END


  Mrv1652304292202192D          

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  6 66  1  0  0  0  0
  4 67  1  6  0  0  0
  3 68  1  6  0  0  0
 68 69  1  0  0  0  0
  1 70  2  0  0  0  0
 70 71  1  0  0  0  0
 71 72  2  0  0  0  0
 72 73  1  0  0  0  0
 73 74  2  0  0  0  0
  1 74  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0079300

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CNC(=O)CC[C@@H](NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)NC(=O)C(C)=O)C(O)=O)\C=C\C(\C)=C\[C@H](C)[C@H](CC1=CC=CC=C1)OC)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C48H75N13O13/c1-26(23-27(2)37(74-7)24-31-13-9-8-10-14-31)17-18-32(28(3)40(65)60-35(45(70)71)19-20-38(63)53-6)58-43(68)33(15-11-21-54-47(49)50)57-39(64)25-36(46(72)73)61-44(69)34(16-12-22-55-48(51)52)59-41(66)29(4)56-42(67)30(5)62/h8-10,13-14,17-18,23,27-29,32-37H,11-12,15-16,19-22,24-25H2,1-7H3,(H,53,63)(H,56,67)(H,57,64)(H,58,68)(H,59,66)(H,60,65)(H,61,69)(H,70,71)(H,72,73)(H4,49,50,54)(H4,51,52,55)/b18-17+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1

> <INCHI_KEY>
RDMMSXPNHDOGME-LTPNNWFFSA-N

> <FORMULA>
C48H75N13O13

> <MOLECULAR_WEIGHT>
1042.206

> <EXACT_MASS>
1041.560729527

> <JCHEM_ACCEPTOR_COUNT>
19

> <JCHEM_ATOM_COUNT>
149

> <JCHEM_AVERAGE_POLARIZABILITY>
109.15276667238959

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
15

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2R)-2-[(2S,3S,4E,6E,8S,9S)-3-[(2S)-5-carbamimidamido-2-[(3R)-3-[(2S)-5-carbamimidamido-2-[(2R)-2-(2-oxopropanamido)propanamido]pentanamido]-3-carboxypropanamido]pentanamido]-9-methoxy-2,6,8-trimethyl-10-phenyldeca-4,6-dienamido]-4-(methylcarbamoyl)butanoic acid

> <ALOGPS_LOGP>
-0.23

> <JCHEM_LOGP>
-5.593618908484395

> <ALOGPS_LOGS>
-5.19

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
3.617964011958379

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.0147889696222676

> <JCHEM_PKA_STRONGEST_BASIC>
12.259921767524656

> <JCHEM_POLAR_SURFACE_AREA>
428.3999999999999

> <JCHEM_REFRACTIVITY>
290.8477000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
34

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
6.74e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2R)-2-[(2S,3S,4E,6E,8S,9S)-3-[(2S)-5-carbamimidamido-2-[(3R)-3-[(2S)-5-carbamimidamido-2-[(2R)-2-(2-oxopropanamido)propanamido]pentanamido]-3-carboxypropanamido]pentanamido]-9-methoxy-2,6,8-trimethyl-10-phenyldeca-4,6-dienamido]-4-(methylcarbamoyl)butanoic 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       9.987 -11.247   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      11.499 -11.538   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      12.507 -10.374   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      14.019 -10.665   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      15.028  -9.501   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      16.540  -9.792   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      17.548  -8.628   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      19.060  -8.919   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      20.068  -7.755   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      19.564  -6.300   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      18.052  -6.009   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0      17.044  -7.173   0.000  0.00  0.00           O+0
HETATM   13  N   UNK     0      17.548  -4.553   0.000  0.00  0.00           N+0
HETATM   14  C   UNK     0      16.036  -4.262   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      15.532  -2.807   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      14.019  -2.516   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      13.515  -1.061   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0      14.524   0.103   0.000  0.00  0.00           O+0
HETATM   19  N   UNK     0      12.003  -0.770   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0      11.499   0.685   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      15.028  -5.427   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      13.515  -5.135   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0      15.532  -6.882   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0      20.573  -5.135   0.000  0.00  0.00           C+0
HETATM   25  N   UNK     0      21.581  -8.046   0.000  0.00  0.00           N+0
HETATM   26  C   UNK     0      22.589  -6.882   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0      22.085  -5.427   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0      24.101  -7.173   0.000  0.00  0.00           C+0
HETATM   29  N   UNK     0      25.109  -6.009   0.000  0.00  0.00           N+0
HETATM   30  C   UNK     0      26.622  -6.300   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      27.126  -7.755   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0      27.630  -5.135   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      29.142  -5.427   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      29.646  -6.882   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0      31.158  -7.173   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0      28.638  -8.046   0.000  0.00  0.00           O+0
HETATM   37  N   UNK     0      30.150  -4.262   0.000  0.00  0.00           N+0
HETATM   38  C   UNK     0      31.662  -4.553   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0      32.166  -6.009   0.000  0.00  0.00           O+0
HETATM   40  C   UNK     0      32.671  -3.389   0.000  0.00  0.00           C+0
HETATM   41  N   UNK     0      34.183  -3.680   0.000  0.00  0.00           N+0
HETATM   42  C   UNK     0      35.191  -2.516   0.000  0.00  0.00           C+0
HETATM   43  O   UNK     0      34.687  -1.061   0.000  0.00  0.00           O+0
HETATM   44  C   UNK     0      36.703  -2.807   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0      37.207  -4.262   0.000  0.00  0.00           C+0
HETATM   46  N   UNK     0      37.711  -1.643   0.000  0.00  0.00           N+0
HETATM   47  C   UNK     0      39.224  -1.934   0.000  0.00  0.00           C+0
HETATM   48  O   UNK     0      39.728  -3.389   0.000  0.00  0.00           O+0
HETATM   49  C   UNK     0      40.232  -0.770   0.000  0.00  0.00           C+0
HETATM   50  O   UNK     0      41.744  -1.061   0.000  0.00  0.00           O+0
HETATM   51  C   UNK     0      39.728   0.685   0.000  0.00  0.00           C+0
HETATM   52  C   UNK     0      32.166  -1.934   0.000  0.00  0.00           C+0
HETATM   53  C   UNK     0      33.175  -0.770   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0      32.671   0.685   0.000  0.00  0.00           C+0
HETATM   55  N   UNK     0      33.679   1.849   0.000  0.00  0.00           N+0
HETATM   56  C   UNK     0      33.175   3.304   0.000  0.00  0.00           C+0
HETATM   57  N   UNK     0      31.662   3.595   0.000  0.00  0.00           N+0
HETATM   58  N   UNK     0      34.183   4.469   0.000  0.00  0.00           N+0
HETATM   59  C   UNK     0      24.605  -8.628   0.000  0.00  0.00           C+0
HETATM   60  C   UNK     0      23.597  -9.792   0.000  0.00  0.00           C+0
HETATM   61  C   UNK     0      24.101 -11.247   0.000  0.00  0.00           C+0
HETATM   62  N   UNK     0      23.093 -12.411   0.000  0.00  0.00           N+0
HETATM   63  C   UNK     0      23.597 -13.866   0.000  0.00  0.00           C+0
HETATM   64  N   UNK     0      25.109 -14.158   0.000  0.00  0.00           N+0
HETATM   65  N   UNK     0      22.589 -15.031   0.000  0.00  0.00           N+0
HETATM   66  C   UNK     0      17.044 -11.247   0.000  0.00  0.00           C+0
HETATM   67  C   UNK     0      14.524 -12.120   0.000  0.00  0.00           C+0
HETATM   68  O   UNK     0      12.003  -8.919   0.000  0.00  0.00           O+0
HETATM   69  C   UNK     0      13.011  -7.755   0.000  0.00  0.00           C+0
HETATM   70  C   UNK     0       8.979 -12.411   0.000  0.00  0.00           C+0
HETATM   71  C   UNK     0       7.466 -12.120   0.000  0.00  0.00           C+0
HETATM   72  C   UNK     0       6.962 -10.665   0.000  0.00  0.00           C+0
HETATM   73  C   UNK     0       7.970  -9.501   0.000  0.00  0.00           C+0
HETATM   74  C   UNK     0       9.483  -9.792   0.000  0.00  0.00           C+0
CONECT    1    2   70   74                                                  
CONECT    2    1    3                                                       
CONECT    3    2    4   68                                                  
CONECT    4    3    5   67                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7   66                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10   25                                                  
CONECT   10    9   11   24                                                  
CONECT   11   10   12   13                                                  
CONECT   12   11                                                            
CONECT   13   11   14                                                       
CONECT   14   13   15   21                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18   19                                                  
CONECT   18   17                                                            
CONECT   19   17   20                                                       
CONECT   20   19                                                            
CONECT   21   14   22   23                                                  
CONECT   22   21                                                            
CONECT   23   21                                                            
CONECT   24   10                                                            
CONECT   25    9   26                                                       
CONECT   26   25   27   28                                                  
CONECT   27   26                                                            
CONECT   28   26   29   59                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30   33                                                       
CONECT   33   32   34   37                                                  
CONECT   34   33   35   36                                                  
CONECT   35   34                                                            
CONECT   36   34                                                            
CONECT   37   33   38                                                       
CONECT   38   37   39   40                                                  
CONECT   39   38                                                            
CONECT   40   38   41   52                                                  
CONECT   41   40   42                                                       
CONECT   42   41   43   44                                                  
CONECT   43   42                                                            
CONECT   44   42   45   46                                                  
CONECT   45   44                                                            
CONECT   46   44   47                                                       
CONECT   47   46   48   49                                                  
CONECT   48   47                                                            
CONECT   49   47   50   51                                                  
CONECT   50   49                                                            
CONECT   51   49                                                            
CONECT   52   40   53                                                       
CONECT   53   52   54                                                       
CONECT   54   53   55                                                       
CONECT   55   54   56                                                       
CONECT   56   55   57   58                                                  
CONECT   57   56                                                            
CONECT   58   56                                                            
CONECT   59   28   60                                                       
CONECT   60   59   61                                                       
CONECT   61   60   62                                                       
CONECT   62   61   63                                                       
CONECT   63   62   64   65                                                  
CONECT   64   63                                                            
CONECT   65   63                                                            
CONECT   66    6                                                            
CONECT   67    4                                                            
CONECT   68    3   69                                                       
CONECT   69   68                                                            
CONECT   70    1   71                                                       
CONECT   71   70   72                                                       
CONECT   72   71   73                                                       
CONECT   73   72   74                                                       
CONECT   74   73    1                                                       
MASTER        0    0    0    0    0    0    0    0   74    0  148    0
END

View in JSmol

Synonyms

Value	Source
Seco(D-asp(3))microcystin-RR	MeSH

Chemical Formula

C₄₈H₇₅N₁₃O₁₃

Average Mass

1042.2060 Da

Monoisotopic Mass

1041.56073 Da

IUPAC Name

(2R)-2-[(2S,3S,4E,6E,8S,9S)-3-[(2S)-5-carbamimidamido-2-[(3R)-3-[(2S)-5-carbamimidamido-2-[(2R)-2-(2-oxopropanamido)propanamido]pentanamido]-3-carboxypropanamido]pentanamido]-9-methoxy-2,6,8-trimethyl-10-phenyldeca-4,6-dienamido]-4-(methylcarbamoyl)butanoic acid

Traditional Name

CAS Registry Number

Not Available

SMILES

CNC(=O)CC[C@@H](NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)NC(=O)C(C)=O)C(O)=O)\C=C\C(\C)=C\[C@H](C)[C@H](CC1=CC=CC=C1)OC)C(O)=O

InChI Identifier

InChI=1S/C48H75N13O13/c1-26(23-27(2)37(74-7)24-31-13-9-8-10-14-31)17-18-32(28(3)40(65)60-35(45(70)71)19-20-38(63)53-6)58-43(68)33(15-11-21-54-47(49)50)57-39(64)25-36(46(72)73)61-44(69)34(16-12-22-55-48(51)52)59-41(66)29(4)56-42(67)30(5)62/h8-10,13-14,17-18,23,27-29,32-37H,11-12,15-16,19-22,24-25H2,1-7H3,(H,53,63)(H,56,67)(H,57,64)(H,58,68)(H,59,66)(H,60,65)(H,61,69)(H,70,71)(H,72,73)(H4,49,50,54)(H4,51,52,55)/b18-17+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1

InChI Key

RDMMSXPNHDOGME-LTPNNWFFSA-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
Planktothrix rubescens	Bacteria	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as hybrid peptides. Hybrid peptides are compounds containing at least two different types of amino acids (alpha, beta, gamma, delta) linked to each other through a peptide bond.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Peptidomimetics

Sub Class

Hybrid peptides

Direct Parent

Hybrid peptides

Alternative Parents

Substituents

Hybrid peptide
Glutamine or derivatives
Asparagine or derivatives
N-acyl-alpha-amino acid
N-acyl-alpha amino acid or derivatives
Alpha-amino acid amide
Beta amino acid or derivatives
Alanine or derivatives
N-substituted-alpha-amino acid
Alpha-amino acid or derivatives
Monocyclic benzene moiety
Dicarboxylic acid or derivatives
Fatty amide
N-acyl-amine
Fatty acyl
Benzenoid
Ketone
Secondary carboxylic acid amide
Guanidine
Carboxamide group
Organic 1,3-dipolar compound
Propargyl-type 1,3-dipolar organic compound
Carboximidamide
Ether
Carboxylic acid derivative
Dialkyl ether
Carboxylic acid
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Carbonyl group
Organonitrogen compound
Organooxygen compound
Hydrocarbon derivative
Organic oxide
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic 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	-0.23	ALOGPS
logP	-5.6	ChemAxon
logS	-5.2	ALOGPS
pKa (Strongest Acidic)	3.01	ChemAxon
pKa (Strongest Basic)	12.26	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	19	ChemAxon
Hydrogen Donor Count	15	ChemAxon
Polar Surface Area	428.4 Å²	ChemAxon
Rotatable Bond Count	34	ChemAxon
Refractivity	290.85 m³·mol⁻¹	ChemAxon
Polarizability	109.15 Å³	ChemAxon
Number of Rings	1	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

Not Available

Chemspider ID

9990230

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

11815573

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for (-)-seco[D-Asp3]microcystin-RR (NP0079300)

MOL for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

3D MOL for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

3D SDF for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

3D-SDF for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

PDB for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

3D PDB for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

SMILES for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

INCHI for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

Structure for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)

3D Structure for NP0079300 ((-)-seco[D-Asp3]microcystin-RR)