NP-MRD: Showing NP-Card for (+)-Sceletium A4 (NP0069392)

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Record Information

Version

2.0

Created at

2022-04-28 14:44:36 UTC

Updated at

2022-04-28 14:44:37 UTC

NP-MRD ID

NP0069392

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(+)-Sceletium A4

Description

(+)-Sceletium A4 belongs to the class of organic compounds known as phenylquinolines. These are heterocyclic compounds containing a quinoline moiety substituted with a phenyl group. (+)-Sceletium A4 is found in Mesembryanthemum ladismithiense, Mesembryanthemum tortuosum, Sceletium namaquense and Sceletium stricum. Based on a literature review a small amount of articles have been published on (+)-Sceletium A4.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 48 51  0  0  0  0  0  0  0  0999 V2000
    4.4992    0.7725   -3.9094 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1765    0.8039   -2.5771 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0121    0.6098   -1.9044 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8126    0.3261   -2.4826 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6829    0.1505   -1.7214 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6967    0.2481   -0.3747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4689    0.0970    0.5392 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6241    1.4508    1.1971 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6332    1.4627    2.2880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8816    0.8086    1.7900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0079    1.1196    2.4558 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2097    0.6026    2.0932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3084   -0.2513    1.0394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1234   -0.5594    0.3658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8938   -0.0433    0.7174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7004   -0.4414   -0.0845 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6021   -1.8622    0.0024 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9370   -2.6133   -1.1505 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4154   -2.2256    0.6842 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1186   -0.9817    1.5382 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9071    0.5362    0.2493 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0720    0.7184   -0.4937 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2582    0.9930    0.0522 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7915    1.1775    1.2540 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3075   -0.2027   -4.4140 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6109    0.9327   -4.0810 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9851    1.5612   -4.4688 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7385    0.2287   -3.5645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2156   -0.0761   -2.2315 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3492    1.7698    1.5578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9590    2.1396    0.3895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2159    0.8955    3.1636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8130    2.4978    2.6312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1195    0.8591    2.6375 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2491   -0.6662    0.7382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2177   -1.2392   -0.4725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8754   -0.0788   -1.1255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1691   -3.2989   -1.5094 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8152   -3.2778   -0.8836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3198   -2.0009   -2.0064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6479   -3.0385    1.4077 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4544   -2.4172    0.0573 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9288   -0.9642    1.8538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8391   -0.9324    2.3647 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0081    0.6307    1.3216 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7296    0.5496    1.4581 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1664    1.0008    2.1733 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1934    2.2285    1.4349 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3 22  2  0
 22 23  1  0
 23 24  1  0
 22 21  1  0
 21  6  2  0
  6  5  1  0
  5  4  2  0
  7  6  1  0
  7 20  1  1
 20 19  1  0
 19 17  1  0
 17 18  1  0
 17 16  1  0
 16 15  1  0
 15 10  2  0
 10  9  1  0
  9  8  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
  4  3  1  0
 16  7  1  0
 14 15  1  0
  8  7  1  0
  1 25  1  0
  1 26  1  0
  1 27  1  0
 24 46  1  0
 24 47  1  0
 24 48  1  0
 21 45  1  0
  5 29  1  0
  4 28  1  0
 20 43  1  0
 20 44  1  0
 19 41  1  0
 19 42  1  0
 18 38  1  0
 18 39  1  0
 18 40  1  0
 16 37  1  6
  9 32  1  0
  9 33  1  0
  8 30  1  0
  8 31  1  0
 12 34  1  0
 13 35  1  0
 14 36  1  0
M  END


  Mrv1652304282216442D          

 24 27  0  0  1  0            999 V2000
    4.6267   -1.4293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3149   -2.1931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4975   -2.3049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9919   -1.6530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3038   -0.8892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1212   -0.7774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7983   -0.2372    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3637    0.4640    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5391    0.4383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1491   -0.2887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5837   -0.9900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4083   -0.9642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3245   -0.3145    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1101    0.3867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2799    1.1137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1045    1.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8963    1.0941    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6601    0.7822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5995   -0.0406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6996    1.8953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8204   -2.8451    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6378   -2.7333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4441   -1.3175    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7560   -0.5537    0.0000 C   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
  7  5  1  1  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  7 12  1  0  0  0  0
 10 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
  9 16  1  0  0  0  0
  8 17  1  6  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
  7 19  1  0  0  0  0
 17 20  1  0  0  0  0
  2 21  1  0  0  0  0
 21 22  1  0  0  0  0
  1 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0069392

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=C(OC)C=C(C=C1)[C@]12CCN(C)[C@H]1C1=C(CC2)N=CC=C1

> <INCHI_IDENTIFIER>
InChI=1S/C20H24N2O2/c1-22-12-10-20(14-6-7-17(23-2)18(13-14)24-3)9-8-16-15(19(20)22)5-4-11-21-16/h4-7,11,13,19H,8-10,12H2,1-3H3/t19-,20-/m0/s1

> <INCHI_KEY>
VDUITLSRHOBYKB-PMACEKPBSA-N

> <FORMULA>
C20H24N2O2

> <MOLECULAR_WEIGHT>
324.424

> <EXACT_MASS>
324.183778021

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
48

> <JCHEM_AVERAGE_POLARIZABILITY>
36.505486671877456

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(3aS,9bR)-3a-(3,4-dimethoxyphenyl)-1-methyl-1H,2H,3H,3aH,4H,5H,9bH-pyrrolo[2,3-f]quinoline

> <ALOGPS_LOGP>
3.25

> <JCHEM_LOGP>
2.6475812586666665

> <ALOGPS_LOGS>
-3.04

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_BASIC>
8.459967179703765

> <JCHEM_POLAR_SURFACE_AREA>
34.59

> <JCHEM_REFRACTIVITY>
94.36129999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.93e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(+)-sceletium A4

> <JCHEM_VEBER_RULE>
1

$$$$

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       8.637  -2.668   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       8.054  -4.094   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       6.529  -4.303   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       5.585  -3.086   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       6.167  -1.660   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       7.693  -1.451   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       5.223  -0.443   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       4.412   0.866   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       2.873   0.818   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       2.145  -0.539   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       2.956  -1.848   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.495  -1.800   0.000  0.00  0.00           C+0
HETATM   13  N   UNK     0       0.606  -0.587   0.000  0.00  0.00           N+0
HETATM   14  C   UNK     0      -0.206   0.722   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       0.522   2.079   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       2.062   2.127   0.000  0.00  0.00           C+0
HETATM   17  N   UNK     0       5.406   2.042   0.000  0.00  0.00           N+0
HETATM   18  C   UNK     0       6.832   1.460   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       6.719  -0.076   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       5.039   3.538   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       8.998  -5.311   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0      10.524  -5.102   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      10.162  -2.459   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0      10.744  -1.034   0.000  0.00  0.00           C+0
CONECT    1    2    6   23                                                  
CONECT    2    1    3   21                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6    7                                                  
CONECT    6    5    1                                                       
CONECT    7    5    8   12   19                                             
CONECT    8    7    9   17                                                  
CONECT    9    8   10   16                                                  
CONECT   10    9   11   13                                                  
CONECT   11   10   12                                                       
CONECT   12   11    7                                                       
CONECT   13   10   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15    9                                                       
CONECT   17    8   18   20                                                  
CONECT   18   17   19                                                       
CONECT   19   18    7                                                       
CONECT   20   17                                                            
CONECT   21    2   22                                                       
CONECT   22   21                                                            
CONECT   23    1   24                                                       
CONECT   24   23                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   54    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₀H₂₄N₂O₂

Average Mass

324.4240 Da

Monoisotopic Mass

324.18378 Da

IUPAC Name

(3aS,9bR)-3a-(3,4-dimethoxyphenyl)-1-methyl-1H,2H,3H,3aH,4H,5H,9bH-pyrrolo[2,3-f]quinoline

Traditional Name

(+)-sceletium A4

CAS Registry Number

Not Available

SMILES

COC1=C(OC)C=C(C=C1)[C@]12CCN(C)[C@H]1C1=C(CC2)N=CC=C1

InChI Identifier

InChI=1S/C20H24N2O2/c1-22-12-10-20(14-6-7-17(23-2)18(13-14)24-3)9-8-16-15(19(20)22)5-4-11-21-16/h4-7,11,13,19H,8-10,12H2,1-3H3/t19-,20-/m0/s1

InChI Key

VDUITLSRHOBYKB-PMACEKPBSA-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
Mesembryanthemum ladismithiense	LOTUS Database	35616633
Mesembryanthemum tortuosum	LOTUS Database	35616633
Sceletium namaquense	Plant	KNApSAcK
Sceletium stricum	Plant	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as phenylquinolines. These are heterocyclic compounds containing a quinoline moiety substituted with a phenyl group.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Quinolines and derivatives

Sub Class

Phenylquinolines

Direct Parent

Phenylquinolines

Alternative Parents

Substituents

Phenylquinoline
Pyrroloquinoline
3-phenylpyrrolidine
Dimethoxybenzene
O-dimethoxybenzene
Indole or derivatives
Anisole
Methoxybenzene
Phenol ether
Phenoxy compound
Alkyl aryl ether
Aralkylamine
Monocyclic benzene moiety
Benzenoid
Pyridine
N-alkylpyrrolidine
Pyrrolidine
Pyrrole
Heteroaromatic compound
Tertiary amine
Tertiary aliphatic amine
Azacycle
Ether
Hydrocarbon derivative
Organic nitrogen compound
Amine
Organooxygen compound
Organonitrogen compound
Organopnictogen compound
Organic oxygen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

quinolines (CHEBI:31020 )

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	3.25	ALOGPS
logP	2.65	ChemAxon
logS	-3	ALOGPS
pKa (Strongest Basic)	8.46	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	34.59 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	94.36 m³·mol⁻¹	ChemAxon
Polarizability	36.51 Å³	ChemAxon
Number of Rings	4	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	Yes	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

391852

KEGG Compound ID

C12259

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

443744

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Showing NP-Card for (+)-Sceletium A4 (NP0069392)

MOL for NP0069392 ((+)-Sceletium A4)

3D MOL for NP0069392 ((+)-Sceletium A4)

3D SDF for NP0069392 ((+)-Sceletium A4)

3D-SDF for NP0069392 ((+)-Sceletium A4)

PDB for NP0069392 ((+)-Sceletium A4)

3D PDB for NP0069392 ((+)-Sceletium A4)

SMILES for NP0069392 ((+)-Sceletium A4)

INCHI for NP0069392 ((+)-Sceletium A4)

Structure for NP0069392 ((+)-Sceletium A4)

3D Structure for NP0069392 ((+)-Sceletium A4)