NP-MRD: Showing NP-Card for Urothion (NP0086962)

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Record Information

Version

2.0

Created at

2022-05-11 16:35:50 UTC

Updated at

2022-05-11 16:35:50 UTC

NP-MRD ID

NP0086962

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Urothion

Description

Urothion belongs to the class of organic compounds known as pterins and derivatives. These are polycyclic aromatic compounds containing a pterin moiety, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one. Urothion is an extremely weak basic (essentially neutral) compound (based on its pKa). Urothion was first documented in 1982 (PMID: 6960353). Urothion is deficient in patients with molybdenum cofactor deficiency (PMID: 6960353 ) (PMID: 8690716) (PMID: 3219233) (PMID: 7957196) (PMID: 2289312).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 32 34  0  0  0  0  0  0  0  0999 V2000
   -0.5971    3.1845    1.2533 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0220    2.1394    0.8849 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4634    0.5015    0.2993 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3968   -0.4321   -0.0362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9024   -0.2926    0.0207 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.2836    0.8988   -0.5192 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5085   -1.5054   -0.5994 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0526   -2.6704    0.0107 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4647   -1.7726   -0.5180 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0934   -1.1212   -0.2843 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3774   -1.5799   -0.4525 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4459   -0.8138   -0.1801 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7041   -1.2788   -0.3559 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7354   -0.4641   -0.0714 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   -0.9486   -0.2600 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5105    0.7915    0.3809 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2854    1.2848    0.5669 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0500    2.4425    0.9838 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1928    0.4592    0.2783 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9545    0.8972    0.4391 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1598    0.1393    0.1691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1058    2.8897    2.2162 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1072    3.1218    0.4136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9816    4.2176    1.4130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2017   -0.3028    1.1074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2529    1.0292   -0.5966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6057   -1.4467   -0.3965 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4167   -1.5391   -1.7034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0406   -3.3814   -0.6884 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8059   -2.2547   -0.7068 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6653   -0.4273   -0.9398 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4659   -1.7654    0.2182 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
  4  9  1  0
  9 10  1  0
 10 21  2  0
 21 20  1  0
 20 19  2  0
 19 17  1  0
 17 18  2  0
 17 16  1  0
 16 14  2  0
 14 15  1  0
 14 13  1  0
 13 12  1  0
 12 11  2  0
  4  5  1  0
  5  6  1  0
  5  7  1  0
  7  8  1  0
 21  3  1  0
 12 19  1  0
 11 10  1  0
  1 22  1  0
  1 23  1  0
  1 24  1  0
 15 31  1  0
 15 32  1  0
 13 30  1  0
  5 25  1  1
  6 26  1  0
  7 27  1  0
  7 28  1  0
  8 29  1  0
M  END


  Mrv0541 02231219312D          

 21 23  0  0  0  0            999 V2000
   22.3696   -9.9362    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   22.1133  -12.0483    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   23.8323  -10.6698    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.6573  -12.0988    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1756   -9.7058    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7057  -12.2293    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.1661  -12.2379    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.4186  -10.9547    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.6182  -12.2094    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.6182  -10.5594    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.4198  -11.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8323  -12.0988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8186   -9.3222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4186  -11.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3326  -11.7969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1661  -10.5307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9036  -11.7969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5947  -11.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1133  -10.7204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9036  -10.9719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3326  -10.9719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  1  0  0  0  0
  1 19  1  0  0  0  0
  2 15  1  0  0  0  0
  2 18  1  0  0  0  0
  3 11  1  0  0  0  0
  4 12  1  0  0  0  0
  5 16  2  0  0  0  0
  6 14  1  0  0  0  0
  7 14  1  0  0  0  0
  7 17  1  0  0  0  0
  8 14  2  0  0  0  0
  8 16  1  0  0  0  0
  9 15  1  0  0  0  0
  9 17  2  0  0  0  0
 10 20  2  0  0  0  0
 10 21  1  0  0  0  0
 11 12  1  0  0  0  0
 11 18  1  0  0  0  0
 15 21  2  0  0  0  0
 16 20  1  0  0  0  0
 17 20  1  0  0  0  0
 18 19  2  0  0  0  0
 19 21  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0086962

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CSC1=C(SC2=C1N=C1C(=O)N=C(N)NC1=N2)C(O)CO

> <INCHI_IDENTIFIER>
InChI=1S/C11H11N5O3S2/c1-20-7-4-10(21-6(7)3(18)2-17)14-8-5(13-4)9(19)16-11(12)15-8/h3,17-18H,2H2,1H3,(H3,12,14,15,16,19)

> <INCHI_KEY>
RPUOVNROVSNPBD-UHFFFAOYSA-N

> <FORMULA>
C11H11N5O3S2

> <MOLECULAR_WEIGHT>
325.367

> <EXACT_MASS>
325.030330623

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_AVERAGE_POLARIZABILITY>
31.25276121688511

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
2-amino-7-(1,2-dihydroxyethyl)-6-(methylsulfanyl)-1H,4H-thieno[3,2-g]pteridin-4-one

> <ALOGPS_LOGP>
0.09

> <JCHEM_LOGP>
0.5519444626666672

> <ALOGPS_LOGS>
-3.23

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.854046499490654

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.608169352487551

> <JCHEM_PKA_STRONGEST_BASIC>
-1.3420399853388658

> <JCHEM_POLAR_SURFACE_AREA>
133.72

> <JCHEM_REFRACTIVITY>
79.6251

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.93e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-amino-7-(1,2-dihydroxyethyl)-6-(methylsulfanyl)-1H-thieno[3,2-g]pteridin-4-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  S   UNK     0      41.757 -18.548   0.000  0.00  0.00           S+0
HETATM    2  S   UNK     0      41.278 -22.490   0.000  0.00  0.00           S+0
HETATM    3  O   UNK     0      44.487 -19.917   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0      46.027 -22.584   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0      35.794 -18.117   0.000  0.00  0.00           O+0
HETATM    6  N   UNK     0      33.051 -22.828   0.000  0.00  0.00           N+0
HETATM    7  N   UNK     0      35.777 -22.844   0.000  0.00  0.00           N+0
HETATM    8  N   UNK     0      34.381 -20.449   0.000  0.00  0.00           N+0
HETATM    9  N   UNK     0      38.487 -22.791   0.000  0.00  0.00           N+0
HETATM   10  N   UNK     0      38.487 -19.711   0.000  0.00  0.00           N+0
HETATM   11  C   UNK     0      43.717 -21.251   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      44.487 -22.584   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      40.728 -17.401   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      34.381 -22.053   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      39.821 -22.021   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      35.777 -19.657   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      37.153 -22.021   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      42.177 -21.251   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      41.278 -20.011   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      37.153 -20.481   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      39.821 -20.481   0.000  0.00  0.00           C+0
CONECT    1   13   19                                                       
CONECT    2   15   18                                                       
CONECT    3   11                                                            
CONECT    4   12                                                            
CONECT    5   16                                                            
CONECT    6   14                                                            
CONECT    7   14   17                                                       
CONECT    8   14   16                                                       
CONECT    9   15   17                                                       
CONECT   10   20   21                                                       
CONECT   11    3   12   18                                                  
CONECT   12    4   11                                                       
CONECT   13    1                                                            
CONECT   14    6    7    8                                                  
CONECT   15    2    9   21                                                  
CONECT   16    5    8   20                                                  
CONECT   17    7    9   20                                                  
CONECT   18    2   11   19                                                  
CONECT   19    1   18   21                                                  
CONECT   20   10   16   17                                                  
CONECT   21   10   15   19                                                  
MASTER        0    0    0    0    0    0    0    0   21    0   46    0
END

View in JSmol

Synonyms

Value	Source
(R)-(8CI)-2-amino-7-(1,2-dihydroxyethyl)-6-(methylthio)-thieno[3,2-g]pteridin-4(1H)-one	HMDB
Urothione	HMDB
2-Amino-7-(1,2-dihydroxyethyl)-6-(methylthio)thieno(3,2-g)pteridin-4(3H)one	HMDB
1-[4-Hydroxy-2-imino-6-(methylsulphanyl)-1H,2H-thieno[3,2-g]pteridin-7-yl]ethane-1,2-diol	HMDB
Urothion	MeSH

Chemical Formula

C₁₁H₁₁N₅O₃S₂

Average Mass

325.3670 Da

Monoisotopic Mass

325.03033 Da

IUPAC Name

2-amino-7-(1,2-dihydroxyethyl)-6-(methylsulfanyl)-1H,4H-thieno[3,2-g]pteridin-4-one

Traditional Name

2-amino-7-(1,2-dihydroxyethyl)-6-(methylsulfanyl)-1H-thieno[3,2-g]pteridin-4-one

CAS Registry Number

Not Available

SMILES

CSC1=C(SC2=C1N=C1C(=O)N=C(N)NC1=N2)C(O)CO

InChI Identifier

InChI=1S/C11H11N5O3S2/c1-20-7-4-10(21-6(7)3(18)2-17)14-8-5(13-4)9(19)16-11(12)15-8/h3,17-18H,2H2,1H3,(H3,12,14,15,16,19)

InChI Key

RPUOVNROVSNPBD-UHFFFAOYSA-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
Anas platyrhynchos	FooDB	FooDB
Anatidae	FooDB	FooDB
Anser anser	FooDB	FooDB
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
Numida meleagris	FooDB	FooDB
Odocoileus	FooDB	FooDB
Oryctolagus	FooDB	FooDB
Ovis aries	FooDB	FooDB
Phasianidae	FooDB	FooDB
Phasianus colchicus	FooDB	FooDB
Struthio camelus	FooDB	FooDB
Sus scrofa	FooDB	FooDB
Sus scrofa domestica	FooDB	FooDB

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pterins and derivatives. These are polycyclic aromatic compounds containing a pterin moiety, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Pteridines and derivatives

Sub Class

Pterins and derivatives

Direct Parent

Pterins and derivatives

Alternative Parents

Substituents

Pterin
Aryl thioether
Aminopyrimidine
Pyrimidone
Alkylarylthioether
Pyrazine
Pyrimidine
Heteroaromatic compound
Vinylogous amide
Thiophene
1,2-diol
Secondary alcohol
Azacycle
Sulfenyl compound
Thioether
Organic nitrogen compound
Hydrocarbon derivative
Organic oxide
Organopnictogen compound
Primary amine
Primary alcohol
Organosulfur compound
Organooxygen compound
Organonitrogen compound
Organic oxygen compound
Alcohol
Amine
Aromatic alcohol
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	0.09	ALOGPS
logP	0.55	ChemAxon
logS	-3.2	ALOGPS
pKa (Strongest Acidic)	7.61	ChemAxon
pKa (Strongest Basic)	-1.3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	133.72 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	79.63 m³·mol⁻¹	ChemAxon
Polarizability	31.25 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

HMDB0002377

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

FDB022985

KNApSAcK ID

Not Available

Chemspider ID

78342

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

6653

PubChem Compound

86845

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Sakurai A, Horibe H, Kuboyama N, Hashimoto Y, Okumura Y: Determination of the absolute configuration of urothion. J Biochem. 1995 Sep;118(3):552-4. doi: 10.1093/oxfordjournals.jbchem.a124944. [PubMed:8690716 ]
Johnson JL, Wuebbens MM, Mandell R, Shih VE: Molybdenum cofactor deficiency in a patient previously characterized as deficient in sulfite oxidase. Biochem Med Metab Biol. 1988 Aug;40(1):86-93. doi: 10.1016/0885-4505(88)90108-9. [PubMed:3219233 ]
Volk M, Meyer O, Frunzke K: Metabolic relationship between the CO dehydrogenase molybdenum cofactor and the excretion of urothione by Hydrogenophaga pseudoflava. Eur J Biochem. 1994 Nov 1;225(3):1063-71. doi: 10.1111/j.1432-1033.1994.1063b.x. [PubMed:7957196 ]
Bamforth FJ, Johnson JL, Davidson AG, Wong LT, Lockitch G, Applegarth DA: Biochemical investigation of a child with molybdenum cofactor deficiency. Clin Biochem. 1990 Dec;23(6):537-42. doi: 10.1016/0009-9120(90)80046-l. [PubMed:2289312 ]
Johnson JL, Rajagopalan KV: Structural and metabolic relationship between the molybdenum cofactor and urothione. Proc Natl Acad Sci U S A. 1982 Nov;79(22):6856-60. doi: 10.1073/pnas.79.22.6856. [PubMed:6960353 ]

Showing NP-Card for Urothion (NP0086962)

MOL for NP0086962 (Urothion)

3D MOL for NP0086962 (Urothion)

3D SDF for NP0086962 (Urothion)

3D-SDF for NP0086962 (Urothion)

PDB for NP0086962 (Urothion)

3D PDB for NP0086962 (Urothion)

SMILES for NP0086962 (Urothion)

INCHI for NP0086962 (Urothion)

Structure for NP0086962 (Urothion)

3D Structure for NP0086962 (Urothion)