NP-MRD: Showing NP-Card for [2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid (NP0150209)

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Record Information

Version

2.0

Created at

2022-09-02 06:14:29 UTC

Updated at

2022-09-02 06:14:29 UTC

NP-MRD ID

NP0150209

Secondary Accession Numbers

None

Natural Product Identification

Common Name

[2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid

Description

{[2-Hydroxy-4-(4-hydroxy-2-imino-1,2,5,8-tetrahydropteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxy}phosphonic acid 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. Based on a literature review very few articles have been published on {[2-hydroxy-4-(4-hydroxy-2-imino-1,2,5,8-tetrahydropteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxy}phosphonic acid.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 38 39  0  0  0  0  0  0  0  0999 V2000
   -7.4844    1.0988   -0.5840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1520    0.3307    0.0127 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8670    0.0972    0.0884 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4078   -0.8997    0.8604 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0714   -1.1655    0.9579 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6031   -2.1947    1.7555 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1638   -0.4125    0.2628 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6522    0.6021   -0.5211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9824    0.8407   -0.5969 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7010    1.3651   -1.2281 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3132    1.0763   -1.1165 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8352    0.0721   -0.3416 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5967   -0.1656   -0.2740 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5559    1.0464   -1.2786 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2397   -1.0567    0.3830 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3489   -2.3396    1.3329 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6935   -1.2405    0.4448 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1207   -2.3698   -0.2749 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5183   -0.0691    0.0643 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8885   -0.3151    0.4116 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8418    1.0063   -0.0134 P   0  0  0  0  0  5  0  0  0  0  0  0
    7.2850    0.5573    0.0433 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5386    1.5095   -1.6072 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6748    2.2816    1.0804 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7551   -0.7136    0.3822 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1825   -3.0282    1.3210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2929    1.6155   -1.2010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0598    2.1443   -1.8313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6117    1.6834   -1.6741 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3417    2.3316   -0.7309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0535   -3.3600    0.4453 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9125   -1.5114    1.5485 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4323   -3.0620   -0.1072 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5922   -0.0342   -1.0501 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2122    0.8979    0.4371 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2319    2.4606   -1.5608 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6859    2.4132    1.2181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5222   -1.4926    1.0048 H   0  0  0  0  0  0  0  0  0  0  0  0
 18 17  1  0
 17 19  1  0
 19 20  1  0
 20 21  1  0
 21 23  1  0
 21 24  1  0
 21 22  2  0
 17 15  1  0
 15 16  1  0
 15 13  2  0
 13 14  1  0
 13 12  1  0
 12 11  2  0
 11 10  1  0
 10  8  1  0
  8  7  2  0
  7 25  1  0
  7  5  1  0
  5  6  1  0
  5  4  2  0
  4  3  1  0
  3  2  2  0
  3  9  1  0
 25 12  1  0
  9  8  1  0
 18 33  1  0
 17 32  1  1
 19 34  1  0
 19 35  1  0
 23 36  1  0
 24 37  1  0
 16 31  1  0
 14 30  1  0
 11 29  1  0
 10 28  1  0
 25 38  1  0
  6 26  1  0
  2  1  1  0
  9 27  1  0
M  END


  Mrv1652309022208142D          

 24 25  0  0  0  0            999 V2000
   -1.4289    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2375    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.8875    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -2.4750    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1283   -3.1895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3033   -1.7605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 N   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
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  2  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  4  0  0  0
 12 14  2  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 11 24  1  0  0  0  0
  6 24  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0150209

> <DATABASE_NAME>
NP-MRD

> <SMILES>
OC(COP(O)(O)=O)C(S)=C(S)C1=CNC2=C(N1)C(O)=NC(=N)N2

> <INCHI_IDENTIFIER>
InChI=1S/C10H14N5O6PS2/c11-10-14-8-5(9(17)15-10)13-3(1-12-8)6(23)7(24)4(16)2-21-22(18,19)20/h1,4,13,16,23-24H,2H2,(H2,18,19,20)(H4,11,12,14,15,17)

> <INCHI_KEY>
AARMQWMPBSVRAR-UHFFFAOYSA-N

> <FORMULA>
C10H14N5O6PS2

> <MOLECULAR_WEIGHT>
395.34

> <EXACT_MASS>
395.012312537

> <JCHEM_ACCEPTOR_COUNT>
10

> <JCHEM_ATOM_COUNT>
38

> <JCHEM_AVERAGE_POLARIZABILITY>
34.86211919806394

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
10

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{[2-hydroxy-4-(4-hydroxy-2-imino-1,2,5,8-tetrahydropteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxy}phosphonic acid

> <ALOGPS_LOGP>
0.30

> <JCHEM_LOGP>
-3.66295565786886

> <ALOGPS_LOGS>
-3.49

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
5.5220673431995815

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.4678177090926416

> <JCHEM_PKA_STRONGEST_BASIC>
7.747371080933474

> <JCHEM_POLAR_SURFACE_AREA>
179.51999999999998

> <JCHEM_REFRACTIVITY>
113.03709999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.29e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
[2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1H-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 02-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   02-SEP-22         0                                  
HETATM    1  N   UNK     0      -2.667   0.000   0.000  0.00  0.00           N+0
HETATM    2  C   UNK     0      -1.334  -0.770   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0      -1.334  -2.310   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       0.000  -4.620   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM    8  N   UNK     0       0.000  -0.000   0.000  0.00  0.00           N+0
HETATM    9  N   UNK     0       2.667  -0.000   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       5.335  -3.080   0.000  0.00  0.00           C+0
HETATM   13  S   UNK     0       6.668  -2.310   0.000  0.00  0.00           S+0
HETATM   14  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM   15  S   UNK     0       4.001  -5.390   0.000  0.00  0.00           S+0
HETATM   16  C   UNK     0       6.668  -5.390   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       6.668  -6.930   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       8.002  -4.620   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       9.336  -5.390   0.000  0.00  0.00           O+0
HETATM   20  P   UNK     0      10.669  -4.620   0.000  0.00  0.00           P+0
HETATM   21  O   UNK     0      12.003  -3.850   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      11.439  -5.954   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       9.899  -3.286   0.000  0.00  0.00           O+0
HETATM   24  N   UNK     0       2.667  -3.080   0.000  0.00  0.00           N+0
CONECT    1    2                                                            
CONECT    2    1    3    8                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4    7   24                                                  
CONECT    7    6    8    9                                                  
CONECT    8    7    2                                                       
CONECT    9    7   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12   24                                                  
CONECT   12   11   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21   22   23                                             
CONECT   21   20                                                            
CONECT   22   20                                                            
CONECT   23   20                                                            
CONECT   24   11    6                                                       
MASTER        0    0    0    0    0    0    0    0   24    0   50    0
END

View in JSmol

Synonyms

Value	Source
{[2-hydroxy-4-(4-hydroxy-2-imino-1,2,5,8-tetrahydropteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxy}phosphonate	Generator
{[2-hydroxy-4-(4-hydroxy-2-imino-1,2,5,8-tetrahydropteridin-6-yl)-3,4-disulphanylbut-3-en-1-yl]oxy}phosphonate	Generator
{[2-hydroxy-4-(4-hydroxy-2-imino-1,2,5,8-tetrahydropteridin-6-yl)-3,4-disulphanylbut-3-en-1-yl]oxy}phosphonic acid	Generator

Chemical Formula

C₁₀H₁₄N₅O₆PS₂

Average Mass

395.3400 Da

Monoisotopic Mass

395.01231 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

OC(COP(O)(O)=O)C(S)=C(S)C1=CNC2=C(N1)C(O)=NC(=N)N2

InChI Identifier

InChI=1S/C10H14N5O6PS2/c11-10-14-8-5(9(17)15-10)13-3(1-12-8)6(23)7(24)4(16)2-21-22(18,19)20/h1,4,13,16,23-24H,2H2,(H2,18,19,20)(H4,11,12,14,15,17)

InChI Key

AARMQWMPBSVRAR-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, 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 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
Monoalkyl phosphate
Secondary aliphatic/aromatic amine
Pyrimidone
Aminopyrimidine
Imidolactam
Alkyl phosphate
Pyrimidine
Phosphoric acid ester
Organic phosphoric acid derivative
Heteroaromatic compound
Vinylogous amide
Secondary alcohol
Lactam
Azacycle
Thioenol
Secondary amine
Enamine
Alkylthiol
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Primary amine
Organosulfur compound
Organooxygen compound
Organonitrogen compound
Amine
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	0.3	ALOGPS
logS	-3.5	ALOGPS

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

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

163045605

PDB ID

Not Available

ChEBI ID

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Good Scents ID

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References

General References

LOTUS database [Link]

Showing NP-Card for [2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid (NP0150209)

MOL for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

3D MOL for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

3D SDF for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

3D-SDF for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

PDB for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

3D PDB for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

SMILES for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

INCHI for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

Structure for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)

3D Structure for NP0150209 ([2-hydroxy-4-(4-hydroxy-2-imino-5,8-dihydro-1h-pteridin-6-yl)-3,4-disulfanylbut-3-en-1-yl]oxyphosphonic acid)