NP-MRD: Showing NP-Card for (4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate (NP0319148)

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Record Information

Version

2.0

Created at

2022-09-11 20:02:25 UTC

Updated at

2022-09-11 20:02:26 UTC

NP-MRD ID

NP0319148

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate

Description

(4AS,6S,7R,7aS)-4-(methoxycarbonyl)-7-methyl-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate belongs to the class of organic compounds known as pyridinecarboxylic acids. Pyridinecarboxylic acids are compounds containing a pyridine ring bearing a carboxylic acid group. Based on a literature review very few articles have been published on (4aS,6S,7R,7aS)-4-(methoxycarbonyl)-7-methyl-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 43 45  0  0  0  0  0  0  0  0999 V2000
   -5.1048    3.4980    0.1284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6341    2.1895    0.4316 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5066    1.6541   -0.1535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9087    2.4129   -0.9901 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0206    0.3138    0.1541 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7134   -0.3892    1.0345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2392   -1.6912    1.3318 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2963   -2.3964    0.5325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5727   -1.6159   -0.4797 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8178   -0.1571   -0.5207 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.6077    0.5222    0.0858 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4382   -0.5219    0.2976 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.7087   -0.1648   -0.2009 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8250   -0.0403    0.6166 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6563   -0.2620    1.8392 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1320    0.3234    0.1279 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3659    0.5795   -1.2275 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6270    0.9183   -1.6190 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6465    1.0050   -0.6934 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4189    0.7567    0.6191 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1871    0.4294    0.9775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0630   -1.8082   -0.3158 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.6079   -2.1507   -1.6079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2891    4.1547   -0.1822 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9009    3.3672   -0.6365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6390    3.8535    1.0475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6081   -0.0093    1.5215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6074   -2.1554    2.1898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8424   -3.2730    0.0757 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5665   -2.8879    1.2422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8067   -2.0357   -1.4983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8668    0.2161   -1.5863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1954    1.3216   -0.5537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8996    1.0221    1.0444 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5531   -0.6635    1.4069 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5384    0.4995   -1.9144 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8549    1.1274   -2.6707 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6574    1.2723   -0.9785 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0214    0.2316    2.0465 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1408   -2.6385    0.4004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1754   -2.3699   -2.3670 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2751   -1.3524   -1.9818 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2280   -3.0855   -1.5484 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 22  1  0
 22 23  1  0
 22 12  1  0
 12 11  1  0
 11 10  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 10  5  1  0
 21 16  1  0
 10  9  1  0
  1 24  1  0
  1 25  1  0
  1 26  1  0
  6 27  1  0
  7 28  1  0
  8 29  1  0
  8 30  1  0
  9 31  1  6
 22 40  1  1
 23 41  1  0
 23 42  1  0
 23 43  1  0
 12 35  1  1
 11 33  1  0
 11 34  1  0
 10 32  1  6
 17 36  1  0
 18 37  1  0
 19 38  1  0
 21 39  1  0
M  END


  Mrv1652309112222022D          

 23 25  0  0  1  0            999 V2000
    3.9934    3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.5645    0.8250    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.7798    1.0799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2949    0.4125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.4699    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0574   -0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4699   -1.0164    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7676   -0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1801   -1.0164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0051   -1.0164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4176   -0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0051    0.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1801    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798   -0.2549    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5249   -1.0396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9  8  1  6  0  0  0
  9 10  1  0  0  0  0
  5 10  1  0  0  0  0
 10 11  1  6  0  0  0
 11 12  1  0  0  0  0
 12 13  1  1  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 16 21  1  0  0  0  0
 12 22  1  0  0  0  0
  9 22  1  0  0  0  0
 22 23  1  1  0  0  0
M  END
> <DATABASE_ID>
NP0319148

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC(=O)C1=CNC[C@@H]2[C@@H](C)[C@H](C[C@H]12)OC(=O)C1=CC=CN=C1

> <INCHI_IDENTIFIER>
InChI=1S/C17H20N2O4/c1-10-13-8-19-9-14(17(21)22-2)12(13)6-15(10)23-16(20)11-4-3-5-18-7-11/h3-5,7,9-10,12-13,15,19H,6,8H2,1-2H3/t10-,12+,13-,15+/m1/s1

> <INCHI_KEY>
POMSZMYEBAWFCN-ZRQNBYAXSA-N

> <FORMULA>
C17H20N2O4

> <MOLECULAR_WEIGHT>
316.357

> <EXACT_MASS>
316.142307132

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
43

> <JCHEM_AVERAGE_POLARIZABILITY>
32.8562294007874

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(4aS,6S,7R,7aS)-4-(methoxycarbonyl)-7-methyl-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate

> <JCHEM_LOGP>
1.3724643709999995

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
3.2410591510423967

> <JCHEM_POLAR_SURFACE_AREA>
77.52

> <JCHEM_REFRACTIVITY>
83.322

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(4aS,6S,7R,7aS)-4-(methoxycarbonyl)-7-methyl-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 11-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-22         0                                  
HETATM    1  C   UNK     0       7.454   6.160   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       7.454   4.620   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       6.121   3.850   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0       4.787   4.620   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       6.121   2.310   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       7.454   1.540   0.000  0.00  0.00           C+0
HETATM    7  N   UNK     0       7.454   0.000   0.000  0.00  0.00           N+0
HETATM    8  C   UNK     0       6.121  -0.770   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       4.787   0.000   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       4.787   1.540   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       3.322   2.016   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.417   0.770   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       0.877   0.770   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       0.107  -0.564   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       0.877  -1.897   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      -1.433  -0.564   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -2.203  -1.897   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -3.743  -1.897   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -4.513  -0.564   0.000  0.00  0.00           C+0
HETATM   20  N   UNK     0      -3.743   0.770   0.000  0.00  0.00           N+0
HETATM   21  C   UNK     0      -2.203   0.770   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       3.322  -0.476   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       2.846  -1.941   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6   10                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10   22                                                  
CONECT   10    9    5   11                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13   22                                                  
CONECT   13   12   14                                                       
CONECT   14   13   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14   17   21                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   16                                                       
CONECT   22   12    9   23                                                  
CONECT   23   22                                                            
MASTER        0    0    0    0    0    0    0    0   23    0   50    0
END

View in JSmol

Synonyms

Value	Source
(4AS,6S,7R,7as)-4-(methoxycarbonyl)-7-methyl-1H,2H,4ah,5H,6H,7H,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylic acid	Generator

Chemical Formula

C₁₇H₂₀N₂O₄

Average Mass

316.3570 Da

Monoisotopic Mass

316.14231 Da

IUPAC Name

(4aS,6S,7R,7aS)-4-(methoxycarbonyl)-7-methyl-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate

Traditional Name

(4aS,6S,7R,7aS)-4-(methoxycarbonyl)-7-methyl-1H,2H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate

CAS Registry Number

Not Available

SMILES

COC(=O)C1=CNC[C@@H]2[C@@H](C)[C@H](C[C@H]12)OC(=O)C1=CC=CN=C1

InChI Identifier

InChI=1S/C17H20N2O4/c1-10-13-8-19-9-14(17(21)22-2)12(13)6-15(10)23-16(20)11-4-3-5-18-7-11/h3-5,7,9-10,12-13,15,19H,6,8H2,1-2H3/t10-,12+,13-,15+/m1/s1

InChI Key

POMSZMYEBAWFCN-ZRQNBYAXSA-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

Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pyridinecarboxylic acids. Pyridinecarboxylic acids are compounds containing a pyridine ring bearing a carboxylic acid group.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Pyridines and derivatives

Sub Class

Pyridinecarboxylic acids and derivatives

Direct Parent

Pyridinecarboxylic acids

Alternative Parents

Substituents

Pyridine carboxylic acid
Tetrahydropyridine
Methyl ester
Enoate ester
Heteroaromatic compound
Alpha,beta-unsaturated carboxylic ester
Vinylogous amide
Carboxylic acid ester
Carboxylic acid derivative
Secondary aliphatic amine
Enamine
Monocarboxylic acid or derivatives
Allylamine
Azacycle
Organonitrogen compound
Amine
Carbonyl group
Organooxygen compound
Organic oxygen compound
Organic oxide
Organic nitrogen compound
Hydrocarbon derivative
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	1.37	ChemAxon
pKa (Strongest Basic)	3.24	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	77.52 Å²	ChemAxon
Rotatable Bond Count	5	ChemAxon
Refractivity	83.32 m³·mol⁻¹	ChemAxon
Polarizability	32.86 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	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

10241552

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

21606100

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for (4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate (NP0319148)

MOL for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

3D MOL for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

3D SDF for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

3D-SDF for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

PDB for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

3D PDB for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

SMILES for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

INCHI for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

Structure for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)

3D Structure for NP0319148 ((4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-1h,2h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyridin-6-yl pyridine-3-carboxylate)