NP-MRD: Showing NP-Card for Aranazole A (NP0018628)

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Record Information

Version

1.0

Created at

2021-01-06 03:17:28 UTC

Updated at

2021-07-15 17:28:43 UTC

NP-MRD ID

NP0018628

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Aranazole A

Provided By

NPAtlas

Description

Aranazole A is found in Fischerella sp. PCC 9339. It was first documented in 2018 (PMID: 30141631). Based on a literature review very few articles have been published on Aranazole A.

Structure

MOL 3D MOL SDF 3D SDF PDB SMILES InChI


  Mrv1652306242104363D          

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    5.5578    3.7890    1.7219 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7248    5.1547    1.2887 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2965    1.1754   -1.0522 H   0  0  0  0  0  0  0  0  0  0  0  0
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  1 37  1  0  0  0  0
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 36 68  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0018628

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H]O[C@]([H])(C1=NC(=C([H])S1)C(=O)C([H])([H])[H])[C@]1([H])OC([H])([H])O[C@]([H])(C([H])([H])[C@]([H])(Cl)[C@@]([H])(Cl)[C@@]([H])(Cl)[C@@]2([H])O[C@]2([H])C(\[H])=C(\[H])[C@@]([H])(Cl)C([H])([H])[C@@]([H])(Cl)C([H])([H])C([H])([H])[H])[C@]1([H])C([H])([H])[H]

> <INCHI_IDENTIFIER>
InChI=1S/C24H32Cl5NO5S/c1-4-13(25)7-14(26)5-6-17-23(35-17)20(29)19(28)15(27)8-18-11(2)22(34-10-33-18)21(32)24-30-16(9-36-24)12(3)31/h5-6,9,11,13-15,17-23,32H,4,7-8,10H2,1-3H3/b6-5-/t11-,13-,14+,15-,17+,18+,19+,20+,21-,22+,23-/m0/s1

> <INCHI_KEY>
RGMRJERYAWLGFL-BDJRNXFDSA-N

> <FORMULA>
C24H32Cl5NO5S

> <MOLECULAR_WEIGHT>
623.83

> <EXACT_MASS>
621.0443828

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
68

> <JCHEM_AVERAGE_POLARIZABILITY>
60.94932170265159

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
1-{2-[(S)-hydroxy[(4R,5S,6R)-5-methyl-6-[(2S,3R,4S)-2,3,4-trichloro-4-[(2S,3R)-3-[(1Z,3S,5S)-3,5-dichlorohept-1-en-1-yl]oxiran-2-yl]butyl]-1,3-dioxan-4-yl]methyl]-1,3-thiazol-4-yl}ethan-1-one

> <ALOGPS_LOGP>
5.60

> <JCHEM_LOGP>
5.645535593

> <ALOGPS_LOGS>
-6.13

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
14.461844830737927

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.12421283348319

> <JCHEM_PKA_STRONGEST_BASIC>
-0.23783634279465293

> <JCHEM_POLAR_SURFACE_AREA>
81.18

> <JCHEM_REFRACTIVITY>
143.5395

> <JCHEM_ROTATABLE_BOND_COUNT>
13

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
4.59e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
1-{2-[(S)-hydroxy[(4R,5S,6R)-5-methyl-6-[(2S,3R,4S)-2,3,4-trichloro-4-[(2S,3R)-3-[(1Z,3S,5S)-3,5-dichlorohept-1-en-1-yl]oxiran-2-yl]butyl]-1,3-dioxan-4-yl]methyl]-1,3-thiazol-4-yl}ethanone

> <JCHEM_VEBER_RULE>
0

$$$$

     RDKit          3D

 68 70  0  0  0  0  0  0  0  0999 V2000
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 29 33  2  0
 33 34  1  0
 24 35  1  0
 35 36  1  0
 12 10  1  0
 35 20  1  0
 34 27  1  0
  1 37  1  0
  1 38  1  0
  1 39  1  0
  2 40  1  0
  2 41  1  0
  3 42  1  6
  5 43  1  0
  5 44  1  0
  6 45  1  1
  8 46  1  0
  9 47  1  0
 10 48  1  6
 12 49  1  1
 13 50  1  6
 15 51  1  1
 17 52  1  6
 19 53  1  0
 19 54  1  0
 20 55  1  1
 22 56  1  0
 22 57  1  0
 24 58  1  1
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 26 60  1  0
 31 61  1  0
 31 62  1  0
 31 63  1  0
 33 64  1  0
 35 65  1  1
 36 66  1  0
 36 67  1  0
 36 68  1  0
M  END

HEADER    PROTEIN                                 24-JUN-21   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-JUN-21         0                                  
HETATM    1  C   UNK     0      -7.768   4.311  -0.996  0.00  0.00           C+0
HETATM    2  C   UNK     0      -6.795   3.270  -0.443  0.00  0.00           C+0
HETATM    3  C   UNK     0      -7.519   2.042   0.009  0.00  0.00           C+0
HETATM    4 Cl   UNK     0      -8.681   2.416   1.308  0.00  0.00          Cl+0
HETATM    5  C   UNK     0      -6.700   0.833   0.261  0.00  0.00           C+0
HETATM    6  C   UNK     0      -5.643   0.907   1.296  0.00  0.00           C+0
HETATM    7 Cl   UNK     0      -6.331   1.325   2.905  0.00  0.00          Cl+0
HETATM    8  C   UNK     0      -4.475   1.738   1.018  0.00  0.00           C+0
HETATM    9  C   UNK     0      -3.416   1.246   0.366  0.00  0.00           C+0
HETATM   10  C   UNK     0      -3.342  -0.140  -0.112  0.00  0.00           C+0
HETATM   11  O   UNK     0      -2.469  -0.282  -1.292  0.00  0.00           O+0
HETATM   12  C   UNK     0      -2.087  -0.860  -0.088  0.00  0.00           C+0
HETATM   13  C   UNK     0      -2.065  -2.359   0.041  0.00  0.00           C+0
HETATM   14 Cl   UNK     0      -2.873  -2.773   1.582  0.00  0.00          Cl+0
HETATM   15  C   UNK     0      -0.663  -2.917   0.118  0.00  0.00           C+0
HETATM   16 Cl   UNK     0       0.089  -2.178   1.546  0.00  0.00          Cl+0
HETATM   17  C   UNK     0       0.058  -2.665  -1.163  0.00  0.00           C+0
HETATM   18 Cl   UNK     0       0.234  -0.959  -1.556  0.00  0.00          Cl+0
HETATM   19  C   UNK     0       1.322  -3.421  -1.359  0.00  0.00           C+0
HETATM   20  C   UNK     0       2.352  -3.177  -0.342  0.00  0.00           C+0
HETATM   21  O   UNK     0       3.517  -3.988  -0.620  0.00  0.00           O+0
HETATM   22  C   UNK     0       4.236  -3.994   0.568  0.00  0.00           C+0
HETATM   23  O   UNK     0       4.820  -2.753   0.828  0.00  0.00           O+0
HETATM   24  C   UNK     0       3.835  -1.832   0.986  0.00  0.00           C+0
HETATM   25  C   UNK     0       4.191  -0.519   1.567  0.00  0.00           C+0
HETATM   26  O   UNK     0       3.073   0.306   1.552  0.00  0.00           O+0
HETATM   27  C   UNK     0       5.305   0.156   0.862  0.00  0.00           C+0
HETATM   28  N   UNK     0       5.576   1.446   0.857  0.00  0.00           N+0
HETATM   29  C   UNK     0       6.603   1.906   0.215  0.00  0.00           C+0
HETATM   30  C   UNK     0       6.925   3.356   0.195  0.00  0.00           C+0
HETATM   31  C   UNK     0       6.089   4.350   0.906  0.00  0.00           C+0
HETATM   32  O   UNK     0       7.926   3.740  -0.439  0.00  0.00           O+0
HETATM   33  C   UNK     0       7.385   0.991  -0.452  0.00  0.00           C+0
HETATM   34  S   UNK     0       6.580  -0.475  -0.104  0.00  0.00           S+0
HETATM   35  C   UNK     0       2.942  -1.792  -0.242  0.00  0.00           C+0
HETATM   36  C   UNK     0       3.715  -1.522  -1.516  0.00  0.00           C+0
HETATM   37  H   UNK     0      -8.453   4.671  -0.224  0.00  0.00           H+0
HETATM   38  H   UNK     0      -7.194   5.179  -1.370  0.00  0.00           H+0
HETATM   39  H   UNK     0      -8.329   3.909  -1.869  0.00  0.00           H+0
HETATM   40  H   UNK     0      -6.035   3.100  -1.222  0.00  0.00           H+0
HETATM   41  H   UNK     0      -6.273   3.791   0.408  0.00  0.00           H+0
HETATM   42  H   UNK     0      -8.193   1.766  -0.878  0.00  0.00           H+0
HETATM   43  H   UNK     0      -6.279   0.516  -0.735  0.00  0.00           H+0
HETATM   44  H   UNK     0      -7.407   0.011   0.566  0.00  0.00           H+0
HETATM   45  H   UNK     0      -5.295  -0.181   1.442  0.00  0.00           H+0
HETATM   46  H   UNK     0      -4.423   2.763   1.339  0.00  0.00           H+0
HETATM   47  H   UNK     0      -2.584   1.915   0.193  0.00  0.00           H+0
HETATM   48  H   UNK     0      -4.290  -0.677  -0.261  0.00  0.00           H+0
HETATM   49  H   UNK     0      -1.234  -0.351   0.410  0.00  0.00           H+0
HETATM   50  H   UNK     0      -2.624  -2.818  -0.800  0.00  0.00           H+0
HETATM   51  H   UNK     0      -0.767  -4.027   0.256  0.00  0.00           H+0
HETATM   52  H   UNK     0      -0.646  -3.053  -2.013  0.00  0.00           H+0
HETATM   53  H   UNK     0       1.744  -3.097  -2.360  0.00  0.00           H+0
HETATM   54  H   UNK     0       1.123  -4.528  -1.504  0.00  0.00           H+0
HETATM   55  H   UNK     0       2.064  -3.490   0.688  0.00  0.00           H+0
HETATM   56  H   UNK     0       3.475  -4.134   1.392  0.00  0.00           H+0
HETATM   57  H   UNK     0       4.965  -4.820   0.631  0.00  0.00           H+0
HETATM   58  H   UNK     0       3.129  -2.303   1.778  0.00  0.00           H+0
HETATM   59  H   UNK     0       4.457  -0.627   2.666  0.00  0.00           H+0
HETATM   60  H   UNK     0       3.329   1.188   1.203  0.00  0.00           H+0
HETATM   61  H   UNK     0       5.288   4.725   0.212  0.00  0.00           H+0
HETATM   62  H   UNK     0       5.558   3.789   1.722  0.00  0.00           H+0
HETATM   63  H   UNK     0       6.725   5.155   1.289  0.00  0.00           H+0
HETATM   64  H   UNK     0       8.297   1.175  -1.052  0.00  0.00           H+0
HETATM   65  H   UNK     0       2.174  -1.025  -0.151  0.00  0.00           H+0
HETATM   66  H   UNK     0       4.618  -2.140  -1.605  0.00  0.00           H+0
HETATM   67  H   UNK     0       3.092  -1.661  -2.415  0.00  0.00           H+0
HETATM   68  H   UNK     0       4.044  -0.450  -1.566  0.00  0.00           H+0
CONECT    1    2   37   38   39                                             
CONECT    2    1    3   40   41                                             
CONECT    3    2    4    5   42                                             
CONECT    4    3                                                            
CONECT    5    3    6   43   44                                             
CONECT    6    5    7    8   45                                             
CONECT    7    6                                                            
CONECT    8    6    9   46                                                  
CONECT    9    8   10   47                                                  
CONECT   10    9   11   12   48                                             
CONECT   11   10   12                                                       
CONECT   12   11   13   10   49                                             
CONECT   13   12   14   15   50                                             
CONECT   14   13                                                            
CONECT   15   13   16   17   51                                             
CONECT   16   15                                                            
CONECT   17   15   18   19   52                                             
CONECT   18   17                                                            
CONECT   19   17   20   53   54                                             
CONECT   20   19   21   35   55                                             
CONECT   21   20   22                                                       
CONECT   22   21   23   56   57                                             
CONECT   23   22   24                                                       
CONECT   24   23   25   35   58                                             
CONECT   25   24   26   27   59                                             
CONECT   26   25   60                                                       
CONECT   27   25   28   34                                                  
CONECT   28   27   29                                                       
CONECT   29   28   30   33                                                  
CONECT   30   29   31   32                                                  
CONECT   31   30   61   62   63                                             
CONECT   32   30                                                            
CONECT   33   29   34   64                                                  
CONECT   34   33   27                                                       
CONECT   35   24   36   20   65                                             
CONECT   36   35   66   67   68                                             
CONECT   37    1                                                            
CONECT   38    1                                                            
CONECT   39    1                                                            
CONECT   40    2                                                            
CONECT   41    2                                                            
CONECT   42    3                                                            
CONECT   43    5                                                            
CONECT   44    5                                                            
CONECT   45    6                                                            
CONECT   46    8                                                            
CONECT   47    9                                                            
CONECT   48   10                                                            
CONECT   49   12                                                            
CONECT   50   13                                                            
CONECT   51   15                                                            
CONECT   52   17                                                            
CONECT   53   19                                                            
CONECT   54   19                                                            
CONECT   55   20                                                            
CONECT   56   22                                                            
CONECT   57   22                                                            
CONECT   58   24                                                            
CONECT   59   25                                                            
CONECT   60   26                                                            
CONECT   61   31                                                            
CONECT   62   31                                                            
CONECT   63   31                                                            
CONECT   64   33                                                            
CONECT   65   35                                                            
CONECT   66   36                                                            
CONECT   67   36                                                            
CONECT   68   36                                                            
MASTER        0    0    0    0    0    0    0    0   68    0  140    0
END

RDKit          3D

68 70  0  0  0  0  0  0  0  0999 V2000
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   -0.6630   -2.9168    0.1180 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0892   -2.1777    1.5460 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    2.1735   -1.0253   -0.1512 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6179   -2.1405   -1.6050 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0917   -1.6607   -2.4150 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0441   -0.4497   -1.5663 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  6  8  1  0
  8  9  2  0
  9 10  1  0
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 30 32  2  0
 29 33  2  0
 33 34  1  0
 24 35  1  0
 35 36  1  0
 12 10  1  0
 35 20  1  0
 34 27  1  0
  1 37  1  0
  1 38  1  0
  1 39  1  0
  2 40  1  0
  2 41  1  0
  3 42  1  6
  5 43  1  0
  5 44  1  0
  6 45  1  1
  8 46  1  0
  9 47  1  0
 10 48  1  6
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 31 63  1  0
 33 64  1  0
 35 65  1  1
 36 66  1  0
 36 67  1  0
 36 68  1  0
M  END

View in JSmol View NMR Assignments

Synonyms

Not Available

Chemical Formula

C₂₄H₃₂Cl₅NO₅S

Average Mass

623.8300 Da

Monoisotopic Mass

621.04438 Da

IUPAC Name

1-{2-[(S)-hydroxy[(4R,5S,6R)-5-methyl-6-[(2S,3R,4S)-2,3,4-trichloro-4-[(2S,3R)-3-[(1Z,3S,5S)-3,5-dichlorohept-1-en-1-yl]oxiran-2-yl]butyl]-1,3-dioxan-4-yl]methyl]-1,3-thiazol-4-yl}ethan-1-one

Traditional Name

1-{2-[(S)-hydroxy[(4R,5S,6R)-5-methyl-6-[(2S,3R,4S)-2,3,4-trichloro-4-[(2S,3R)-3-[(1Z,3S,5S)-3,5-dichlorohept-1-en-1-yl]oxiran-2-yl]butyl]-1,3-dioxan-4-yl]methyl]-1,3-thiazol-4-yl}ethanone

CAS Registry Number

Not Available

SMILES

CCC(Cl)CC(Cl)\C=C/[C@H]1O[C@@H]1C(Cl)C(Cl)C(Cl)CC1OCO[C@@H](C(O)C2=NC(=CS2)C(C)=O)C1C

InChI Identifier

InChI=1S/C24H32Cl5NO5S/c1-4-13(25)7-14(26)5-6-17-23(35-17)20(29)19(28)15(27)8-18-11(2)22(34-10-33-18)21(32)24-30-16(9-36-24)12(3)31/h5-6,9,11,13-15,17-23,32H,4,7-8,10H2,1-3H3/b6-5-/t11?,13?,14?,15?,17-,18?,19?,20?,21?,22-,23+/m1/s1

InChI Key

RGMRJERYAWLGFL-BDJRNXFDSA-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
Fischerella sp. PCC 9339	NPAtlas	30141631

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
logP	5.6	ALOGPS
logP	5.65	ChemAxon
logS	-6.1	ALOGPS
pKa (Strongest Acidic)	12.12	ChemAxon
pKa (Strongest Basic)	-0.24	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	6	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	81.18 Å²	ChemAxon
Rotatable Bond Count	13	ChemAxon
Refractivity	143.54 m³·mol⁻¹	ChemAxon
Polarizability	60.95 Å³	ChemAxon
Number of Rings	3	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

NPAtlas ID

NPA023958

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

78445746

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

139591170

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Moosmann P, Ueoka R, Gugger M, Piel J: Aranazoles: Extensively Chlorinated Nonribosomal Peptide-Polyketide Hybrids from the Cyanobacterium Fischerella sp. PCC 9339. Org Lett. 2018 Sep 7;20(17):5238-5241. doi: 10.1021/acs.orglett.8b02193. Epub 2018 Aug 24. [PubMed:30141631 ]

Showing NP-Card for Aranazole A (NP0018628)

MOL for NP0018628 (Aranazole A)

3D MOL for NP0018628 (Aranazole A)

3D SDF for NP0018628 (Aranazole A)

3D-SDF for NP0018628 (Aranazole A)

PDB for NP0018628 (Aranazole A)

3D PDB for NP0018628 (Aranazole A)

SMILES for NP0018628 (Aranazole A)

INCHI for NP0018628 (Aranazole A)

Structure for NP0018628 (Aranazole A)

3D Structure for NP0018628 (Aranazole A)