NP-MRD: Showing NP-Card for salsolinol (NP0030709)

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Record Information

Version

2.0

Created at

2021-06-19 21:59:27 UTC

Updated at

2021-06-29 23:58:51 UTC

NP-MRD ID

NP0030709

Secondary Accession Numbers

None

Natural Product Identification

Common Name

salsolinol

Provided By

JEOL Database JEOL Logo

Description

Salsolinol belongs to the class of organic compounds known as tetrahydroisoquinolines. These are tetrahydrogenated isoquinoline derivatives. Salsolinol has been detected, but not quantified in, several different foods, such as bananas (Musa acuminata), cocoa beans (Theobroma cacao), french plantains (Musa X paradisiaca), and opium poppies (Papaver somniferum). This could make salsolinol a potential biomarker for the consumption of these foods. Salsolinol is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. salsolinol is found in Aconitum carmichaeli , Aristolochia arcuata and Tinospora crispa . salsolinol was first documented in 2018 (PMID: 30251672). Based on a literature review a significant number of articles have been published on Salsolinol (PMID: 33871963) (PMID: 33355691) (PMID: 33277238) (PMID: 33080132) (PMID: 32881676) (PMID: 31240312).

Structure

MOL 3D MOL SDF 3D SDF PDB SMILES InChI


  Mrv1652306192123593D          

 26 27  0  0  0  0            999 V2000
    1.0911    1.6493    0.5634 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7644    0.4018    1.1502 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.0571    0.2536    0.4514 N   0  0  1  0  0  0  0  0  0  0  0  0
    3.7241   -0.9771    0.8774 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.9413   -2.2106    0.4260 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4720   -2.1073    0.7583 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6767   -3.2660    0.7084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6762   -3.1805    1.0055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4950   -4.2753    0.9792 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2401   -1.9584    1.3501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5695   -1.8835    1.6555 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4709   -0.8032    1.3935 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8971   -0.8521    1.0738 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2099    1.9429    1.1428 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7727    1.4868   -0.4731 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7737    2.5075    0.5778 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9696    0.5955    2.2114 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8733    0.2042   -0.5508 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8537   -0.9763    1.9672 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7303   -1.0089    0.4449 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3713   -3.0982    0.9048 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0386   -2.3326   -0.6602 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1285   -4.2170    0.4431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9595   -5.0459    0.7240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8931   -2.8011    1.5580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9522    0.1252    1.6858 H   0  0  0  0  0  0  0  0  0  0  0  0
 12 13  2  0  0  0  0
  8 10  2  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  6  5  1  0  0  0  0
 13  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  6 13  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
  2  1  1  0  0  0  0
 12 26  1  0  0  0  0
  7 23  1  0  0  0  0
  2 17  1  1  0  0  0
  3 18  1  0  0  0  0
  4 19  1  0  0  0  0
  4 20  1  0  0  0  0
  5 21  1  0  0  0  0
  5 22  1  0  0  0  0
  9 24  1  0  0  0  0
 11 25  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
M  END


  Mrv1652306192123593D          

 26 27  0  0  0  0            999 V2000
    1.0911    1.6493    0.5634 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7644    0.4018    1.1502 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.0571    0.2536    0.4514 N   0  0  1  0  0  0  0  0  0  0  0  0
    3.7241   -0.9771    0.8774 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.9413   -2.2106    0.4260 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4720   -2.1073    0.7583 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6767   -3.2660    0.7084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6762   -3.1805    1.0055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4950   -4.2753    0.9792 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2401   -1.9584    1.3501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5695   -1.8835    1.6555 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4709   -0.8032    1.3935 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8971   -0.8521    1.0738 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2099    1.9429    1.1428 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7727    1.4868   -0.4731 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7737    2.5075    0.5778 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9696    0.5955    2.2114 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8733    0.2042   -0.5508 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8537   -0.9763    1.9672 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7303   -1.0089    0.4449 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3713   -3.0982    0.9048 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0386   -2.3326   -0.6602 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1285   -4.2170    0.4431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9595   -5.0459    0.7240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8931   -2.8011    1.5580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9522    0.1252    1.6858 H   0  0  0  0  0  0  0  0  0  0  0  0
 12 13  2  0  0  0  0
  8 10  2  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  6  5  1  0  0  0  0
 13  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  6 13  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
  2  1  1  0  0  0  0
 12 26  1  0  0  0  0
  7 23  1  0  0  0  0
  2 17  1  1  0  0  0
  3 18  1  0  0  0  0
  4 19  1  0  0  0  0
  4 20  1  0  0  0  0
  5 21  1  0  0  0  0
  5 22  1  0  0  0  0
  9 24  1  0  0  0  0
 11 25  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0030709

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H]OC1=C(O[H])C([H])=C2C(=C1[H])C([H])([H])C([H])([H])N([H])[C@@]2([H])C([H])([H])[H]

> <INCHI_IDENTIFIER>
InChI=1S/C10H13NO2/c1-6-8-5-10(13)9(12)4-7(8)2-3-11-6/h4-6,11-13H,2-3H2,1H3/t6-/m0/s1

> <INCHI_KEY>
IBRKLUSXDYATLG-LURJTMIESA-N

> <FORMULA>
C10H13NO2

> <MOLECULAR_WEIGHT>
179.2157

> <EXACT_MASS>
179.094628665

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
26

> <JCHEM_AVERAGE_POLARIZABILITY>
19.284692087286487

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(1S)-1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol

> <ALOGPS_LOGP>
0.16

> <JCHEM_LOGP>
1.067127845432129

> <ALOGPS_LOGS>
-1.43

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
12.826005630597773

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.52443980965133

> <JCHEM_PKA_STRONGEST_BASIC>
8.492597186151377

> <JCHEM_POLAR_SURFACE_AREA>
52.489999999999995

> <JCHEM_REFRACTIVITY>
50.99620000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
6.71e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
salsolinol

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 19-JUN-21   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   19-JUN-21         0                                  
HETATM    1  C   UNK     0       1.091   1.649   0.563  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.764   0.402   1.150  0.00  0.00           C+0
HETATM    3  N   UNK     0       3.057   0.254   0.451  0.00  0.00           N+0
HETATM    4  C   UNK     0       3.724  -0.977   0.877  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.941  -2.211   0.426  0.00  0.00           C+0
HETATM    6  C   UNK     0       1.472  -2.107   0.758  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.677  -3.266   0.708  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.676  -3.180   1.006  0.00  0.00           C+0
HETATM    9  O   UNK     0      -1.495  -4.275   0.979  0.00  0.00           O+0
HETATM   10  C   UNK     0      -1.240  -1.958   1.350  0.00  0.00           C+0
HETATM   11  O   UNK     0      -2.570  -1.884   1.656  0.00  0.00           O+0
HETATM   12  C   UNK     0      -0.471  -0.803   1.393  0.00  0.00           C+0
HETATM   13  C   UNK     0       0.897  -0.852   1.074  0.00  0.00           C+0
HETATM   14  H   UNK     0       0.210   1.943   1.143  0.00  0.00           H+0
HETATM   15  H   UNK     0       0.773   1.487  -0.473  0.00  0.00           H+0
HETATM   16  H   UNK     0       1.774   2.507   0.578  0.00  0.00           H+0
HETATM   17  H   UNK     0       1.970   0.596   2.211  0.00  0.00           H+0
HETATM   18  H   UNK     0       2.873   0.204  -0.551  0.00  0.00           H+0
HETATM   19  H   UNK     0       3.854  -0.976   1.967  0.00  0.00           H+0
HETATM   20  H   UNK     0       4.730  -1.009   0.445  0.00  0.00           H+0
HETATM   21  H   UNK     0       3.371  -3.098   0.905  0.00  0.00           H+0
HETATM   22  H   UNK     0       3.039  -2.333  -0.660  0.00  0.00           H+0
HETATM   23  H   UNK     0       1.129  -4.217   0.443  0.00  0.00           H+0
HETATM   24  H   UNK     0      -0.960  -5.046   0.724  0.00  0.00           H+0
HETATM   25  H   UNK     0      -2.893  -2.801   1.558  0.00  0.00           H+0
HETATM   26  H   UNK     0      -0.952   0.125   1.686  0.00  0.00           H+0
CONECT    1    2   14   15   16                                             
CONECT    2   13    3    1   17                                             
CONECT    3    2    4   18                                                  
CONECT    4    3    5   19   20                                             
CONECT    5    6    4   21   22                                             
CONECT    6    7    5   13                                                  
CONECT    7    6    8   23                                                  
CONECT    8   10    7    9                                                  
CONECT    9    8   24                                                       
CONECT   10    8   11   12                                                  
CONECT   11   10   25                                                       
CONECT   12   13   10   26                                                  
CONECT   13   12    2    6                                                  
CONECT   14    1                                                            
CONECT   15    1                                                            
CONECT   16    1                                                            
CONECT   17    2                                                            
CONECT   18    3                                                            
CONECT   19    4                                                            
CONECT   20    4                                                            
CONECT   21    5                                                            
CONECT   22    5                                                            
CONECT   23    7                                                            
CONECT   24    9                                                            
CONECT   25   11                                                            
CONECT   26   12                                                            
MASTER        0    0    0    0    0    0    0    0   26    0   54    0
END

View in JSmol

Synonyms

Value	Source
(-)-Salsolinol	HMDB
1,2,3,4-Tetrahydro-1-methyl-(S)-6,7-isoquinolinediol	HMDB
Salsolinol, (S)-isomer	HMDB
Salsolinol hydrobromide	HMDB
Salsolinol, (+-)-isomer	HMDB
1-Methyl-6,7-dihydroxytetrahydroisoquinoline	HMDB
Salsolinol	KEGG

Chemical Formula

C₁₀H₁₃NO₂

Average Mass

179.2157 Da

Monoisotopic Mass

179.09463 Da

IUPAC Name

(1S)-1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol

Traditional Name

salsolinol

CAS Registry Number

Not Available

SMILES

[H]OC1=C(O[H])C([H])=C2C(=C1[H])C([H])([H])C([H])([H])N([H])[C@@]2([H])C([H])([H])[H]

InChI Identifier

InChI=1S/C10H13NO2/c1-6-8-5-10(13)9(12)4-7(8)2-3-11-6/h4-6,11-13H,2-3H2,1H3/t6-/m0/s1

InChI Key

IBRKLUSXDYATLG-LURJTMIESA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, simulated)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Aconitum carmichaeli	KNApSAcK Database	22123792
Aconitum carmichaelii	Plant	KNApSAcK
Anas platyrhynchos	FooDB	FooDB
Anatidae	FooDB	FooDB
Annona reticulata	KNApSAcK Database	22123792
Anser anser	FooDB	FooDB
Aristolochia arcuata	JEOL database	Francisco, M. C., et al., Phytochemistry 62, 1265 (2003)
Bison bison	FooDB	FooDB
Bos taurus	FooDB	FooDB
Bos taurus X Bison bison	FooDB	FooDB
Bubalus bubalis	FooDB	FooDB
Capra aegagrus hircus	FooDB	FooDB
Cervidae	FooDB	FooDB
Cervus canadensis	FooDB	FooDB
Columba	FooDB	FooDB
Columbidae	FooDB	FooDB
Dromaius novaehollandiae	FooDB	FooDB
Equus caballus	FooDB	FooDB
Gallus gallus	FooDB	FooDB
Lagopus muta	FooDB	FooDB
Leporidae	FooDB	FooDB
Lepus timidus	FooDB	FooDB
Melanitta fusca	FooDB	FooDB
Meleagris gallopavo	FooDB	FooDB
Musa paradisiaca	KNApSAcK Database	22123792
Musa x paradisiaca	KNApSAcK Database	22123792
Numida meleagris	FooDB	FooDB
Odocoileus	FooDB	FooDB
Oryctolagus	FooDB	FooDB
Ovis aries	FooDB	FooDB
Papaver somniferum	KNApSAcK Database	22123792
Phasianidae	FooDB	FooDB
Phasianus colchicus	FooDB	FooDB
Struthio camelus	FooDB	FooDB
Sus scrofa	FooDB	FooDB
Sus scrofa domestica	FooDB	FooDB
Theobroma cacao	KNApSAcK Database	22123792
Tinospora crispa	Plant	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as tetrahydroisoquinolines. These are tetrahydrogenated isoquinoline derivatives.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Tetrahydroisoquinolines

Sub Class

Not Available

Direct Parent

Tetrahydroisoquinolines

Alternative Parents

Substituents

Tetrahydroisoquinoline
1-hydroxy-2-unsubstituted benzenoid
Aralkylamine
Benzenoid
Azacycle
Secondary amine
Secondary aliphatic amine
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Hydrocarbon derivative
Organooxygen compound
Organonitrogen compound
Amine
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

isoquinolines (CHEBI:113 )
Isoquinoline alkaloids (C09642 )

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	0.16	ALOGPS
logP	1.07	ChemAxon
logS	-1.4	ALOGPS
pKa (Strongest Acidic)	9.52	ChemAxon
pKa (Strongest Basic)	8.49	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	3	ChemAxon
Hydrogen Donor Count	3	ChemAxon
Polar Surface Area	52.49 Å²	ChemAxon
Rotatable Bond Count	0	ChemAxon
Refractivity	51 m³·mol⁻¹	ChemAxon
Polarizability	19.28 Å³	ChemAxon
Number of Rings	2	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

HMDB0042012

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

91588

PDB ID

Not Available

ChEBI ID

113

Good Scents ID

Not Available

References

General References

Kim S, Jang EY, Song SH, Kim JS, Ryu IS, Jeong CH, Lee S: Brain Microdialysis Coupled to LC-MS/MS Revealed That CVT-10216, a Selective Inhibitor of Aldehyde Dehydrogenase 2, Alters the Neurochemical and Behavioral Effects of Methamphetamine. ACS Chem Neurosci. 2021 May 5;12(9):1552-1562. doi: 10.1021/acschemneuro.1c00039. Epub 2021 Apr 19. [PubMed:33871963 ]
Capetian P, Roessner V, Korte C, Walitza S, Riederer F, Taurines R, Gerlach M, Moser A: Altered urinary tetrahydroisoquinoline derivatives in patients with Tourette syndrome: reflection of dopaminergic hyperactivity? J Neural Transm (Vienna). 2021 Jan;128(1):115-120. doi: 10.1007/s00702-020-02289-6. Epub 2020 Dec 23. [PubMed:33355691 ]
Britto-Junior J, Fernandes Jacintho F, Campos R, Pinheiro DHA, Figueiredo Murari GM, de Souza VB, Schenka AA, Monica FZ, Moreno RA, Antunes E, De Nucci G: The basal release of endothelium-derived catecholamines regulates the contractions of Chelonoidis carbonaria aorta caused by electrical-field stimulation. Biol Open. 2021 Jan 20;10(1). pii: bio.057042. doi: 10.1242/bio.057042. [PubMed:33277238 ]
Carmo-Goncalves P, Romao L, Follmer C: In Vitro Protective Action of Monomeric and Fibrillar alpha-Synuclein on Neuronal Cells Exposed to the Dopaminergic Toxins Salsolinol and DOPAL. ACS Chem Neurosci. 2020 Nov 4;11(21):3541-3548. doi: 10.1021/acschemneuro.0c00527. Epub 2020 Oct 20. [PubMed:33080132 ]
Voon SM, Ng KY, Chye SM, Ling APK, Voon KGL, Yap YJ, Koh RY: The Mechanism of Action of Salsolinol in Brain: Implications in Parkinson's Disease. CNS Neurol Disord Drug Targets. 2020;19(10):725-740. doi: 10.2174/1871527319666200902134129. [PubMed:32881676 ]
Vazquez-Manjarrez N, Weinert CH, Ulaszewska MM, Mack CI, Micheau P, Petera M, Durand S, Pujos-Guillot E, Egert B, Mattivi F, Bub A, Dragsted LO, Kulling SE, Manach C: Discovery and Validation of Banana Intake Biomarkers Using Untargeted Metabolomics in Human Intervention and Cross-sectional Studies. J Nutr. 2019 Oct 1;149(10):1701-1713. doi: 10.1093/jn/nxz125. [PubMed:31240312 ]
Berrios-Carcamo P, Rivera-Meza M, Herrera-Marschitz M, Zapata-Torres G: Molecular modeling of salsolinol, a full Gi protein agonist of the mu-opioid receptor, within the receptor binding site. Chem Biol Drug Des. 2019 Aug;94(2):1467-1477. doi: 10.1111/cbdd.13523. Epub 2019 May 3. [PubMed:30920734 ]
do Carmo-Goncalves P, Coelho-Cerqueira E, Cortines JR, de Souza TLF, Romao L, Follmer C: In vitro neurotoxicity of salsolinol is attenuated by the presynaptic protein alpha-synuclein. Biochim Biophys Acta Gen Subj. 2018 Dec;1862(12):2835-2845. doi: 10.1016/j.bbagen.2018.08.022. Epub 2018 Sep 3. [PubMed:30251672 ]
Chen X, Zheng X, Ali S, Guo M, Zhong R, Chen Z, Zhang Y, Qing H, Deng Y: Isolation and Sequencing of Salsolinol Synthase, an Enzyme Catalyzing Salsolinol Biosynthesis. ACS Chem Neurosci. 2018 Jun 20;9(6):1388-1398. doi: 10.1021/acschemneuro.8b00023. Epub 2018 Apr 12. [PubMed:29602279 ]
Zheng X, Chen X, Guo M, Ali S, Huang Y, Sun F, Liu K, Chen Z, Deng Y, Zhong R: Changes in salsolinol production and salsolinol synthase activity in Parkinson's disease model. Neurosci Lett. 2018 Apr 23;673:39-43. doi: 10.1016/j.neulet.2018.02.024. Epub 2018 Feb 15. [PubMed:29454627 ]
Francisco, M. C., et al. (2003). Francisco, M. C., et al., Phytochemistry 62, 1265 (2003) . Phytochem..

Showing NP-Card for salsolinol (NP0030709)

MOL for NP0030709 (salsolinol)

3D MOL for NP0030709 (salsolinol)

3D SDF for NP0030709 (salsolinol)

3D-SDF for NP0030709 (salsolinol)

PDB for NP0030709 (salsolinol)

3D PDB for NP0030709 (salsolinol)

SMILES for NP0030709 (salsolinol)

INCHI for NP0030709 (salsolinol)

Structure for NP0030709 (salsolinol)

3D Structure for NP0030709 (salsolinol)