NP-MRD: Showing NP-Card for (2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid (NP0307815)

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Record Information

Version

2.0

Created at

2022-09-11 01:12:43 UTC

Updated at

2022-09-11 01:12:43 UTC

NP-MRD ID

NP0307815

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid

Description

Arg-gly-asp, also known as RGD peptide, belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds. (2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid is found in Bitis arietans. (2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid was first documented in 2022 (PMID: 36101969). Based on a literature review a small amount of articles have been published on Arg-gly-asp (PMID: 36015343) (PMID: 35974873) (PMID: 35970425) (PMID: 35948498).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 46 45  0  0  0  0  0  0  0  0999 V2000
   -7.3915   -1.1071   -0.2374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5661   -0.0888   -0.2259 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7002    0.8127   -0.4640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9889    2.2026   -0.4361 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3550    0.4179   -0.7792 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4790   -0.1128    0.2415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1433   -0.4419   -0.3507 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1720   -0.9986    0.6401 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8701   -1.2774   -0.1251 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.1234   -2.2340   -1.1899 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1862   -1.7498    0.7977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0105   -2.9467    1.4879 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2854   -1.1301    1.0121 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7254    0.0972    0.4408 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4971   -0.1033   -0.8078 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8103   -0.7563   -1.8503 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7121    0.2805   -0.9617 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4312    0.9440    0.0773 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.9032    1.1370   -0.2826 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5611   -0.1761   -0.5186 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9722   -1.2775   -0.4298 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9069   -0.1697   -0.8568 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9051    2.3299    0.3255 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9561    2.8118   -0.3140 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5080    3.0976    1.3102 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4128    2.7030   -1.2556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7940    2.8031    0.4048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9783    0.5033   -1.7461 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9361   -1.0517    0.6611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3782    0.5788    1.1050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2021   -1.1014   -1.2274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7030    0.5336   -0.7123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9735   -0.2848    1.4576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5377   -1.9308    1.1252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5525   -0.2979   -0.5312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2218   -2.6538   -1.5015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6495   -3.0386   -0.7346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4799   -2.8765    2.3841 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4228    0.5702    1.1954 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9358    0.8425    0.2311 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0114   -1.7379   -1.9957 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4382    0.3812    1.0285 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3574    1.6980    0.5518 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9245    1.7131   -1.2114 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1649   -0.7653   -1.6546 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0043    3.8508    1.7926 H   0  0  0  0  0  0  0  0  0  0  0  0
 10  9  1  0
  9  8  1  0
  8  7  1  0
  7  6  1  0
  6  5  1  0
  5  3  1  0
  3  4  1  0
  3  2  2  0
  9 11  1  0
 11 12  1  0
 11 13  2  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 15 17  2  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 22  1  0
 20 21  2  0
 18 23  1  0
 23 25  1  0
 23 24  2  0
 10 36  1  0
 10 37  1  0
  9 35  1  6
  8 33  1  0
  8 34  1  0
  7 31  1  0
  7 32  1  0
  6 29  1  0
  6 30  1  0
  5 28  1  0
  4 26  1  0
  4 27  1  0
  2  1  1  0
 12 38  1  0
 14 39  1  0
 14 40  1  0
 16 41  1  0
 18 42  1  1
 19 43  1  0
 19 44  1  0
 22 45  1  0
 25 46  1  0
M  END


  Mrv1652309112203122D          

 24 23  0  0  1  0            999 V2000
    1.0461    1.4289    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7605    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7605    2.6664    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750    1.4289    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9039    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6184    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    1.4289    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.3329    0.6039    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0474    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0474    2.6664    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7618    1.4289    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4763    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4763    2.6664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7618    3.0789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1908    3.0789    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1908    3.9039    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.4763    4.3164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4763    5.1414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7618    5.5539    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1908    5.5539    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9052    4.3164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9052    5.1414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6197    3.9039    0.0000 O   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
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  1  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
 12 13  1  4  0  0  0
 13 14  1  0  0  0  0
 14 15  1  4  0  0  0
 14 16  2  0  0  0  0
 17 16  1  1  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 17 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0307815

> <DATABASE_NAME>
NP-MRD

> <SMILES>
N[C@@H](CCCNC(N)=N)C(O)=NCC(O)=N[C@@H](CC(O)=O)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C12H22N6O6/c13-6(2-1-3-16-12(14)15)10(22)17-5-8(19)18-7(11(23)24)4-9(20)21/h6-7H,1-5,13H2,(H,17,22)(H,18,19)(H,20,21)(H,23,24)(H4,14,15,16)/t6-,7-/m0/s1

> <INCHI_KEY>
IYMAXBFPHPZYIK-BQBZGAKWSA-N

> <FORMULA>
C12H22N6O6

> <MOLECULAR_WEIGHT>
346.344

> <EXACT_MASS>
346.160082452

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_ATOM_COUNT>
46

> <JCHEM_AVERAGE_POLARIZABILITY>
33.70470601806726

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
8

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S)-2-[(2-{[(2S)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid

> <JCHEM_LOGP>
-6.343448393474322

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
3.449283165614375

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.8393691767101283

> <JCHEM_PKA_STRONGEST_BASIC>
12.162583961112924

> <JCHEM_POLAR_SURFACE_AREA>
227.7

> <JCHEM_REFRACTIVITY>
91.10279999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
(2S)-2-[(2-{[(2S)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid

> <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  N   UNK     0       1.953   2.667   0.000  0.00  0.00           N+0
HETATM    2  C   UNK     0       3.286   3.437   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0       3.286   4.977   0.000  0.00  0.00           N+0
HETATM    4  N   UNK     0       4.620   2.667   0.000  0.00  0.00           N+0
HETATM    5  C   UNK     0       5.954   3.437   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       7.287   2.667   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       8.621   3.437   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       9.955   2.667   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0       9.955   1.127   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0      11.288   3.437   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      11.288   4.977   0.000  0.00  0.00           O+0
HETATM   12  N   UNK     0      12.622   2.667   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0      13.956   3.437   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      13.956   4.977   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      12.622   5.747   0.000  0.00  0.00           O+0
HETATM   16  N   UNK     0      15.289   5.747   0.000  0.00  0.00           N+0
HETATM   17  C   UNK     0      15.289   7.287   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      13.956   8.057   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      13.956   9.597   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      12.622  10.367   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      15.289  10.367   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0      16.623   8.057   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      16.623   9.597   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0      17.957   7.287   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    7    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14   17                                                       
CONECT   17   16   18   22                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19                                                            
CONECT   22   17   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   46    0
END

View in JSmol

Synonyms

Value	Source
Arginyl-glycyl-aspartic acid	MeSH
RGD Peptide	MeSH
RGD Tripeptide	MeSH

Chemical Formula

C₁₂H₂₂N₆O₆

Average Mass

346.3440 Da

Monoisotopic Mass

346.16008 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

N[C@@H](CCCNC(N)=N)C(O)=NCC(O)=N[C@@H](CC(O)=O)C(O)=O

InChI Identifier

InChI=1S/C12H22N6O6/c13-6(2-1-3-16-12(14)15)10(22)17-5-8(19)18-7(11(23)24)4-9(20)21/h6-7H,1-5,13H2,(H,17,22)(H,18,19)(H,20,21)(H,23,24)(H4,14,15,16)/t6-,7-/m0/s1

InChI Key

IYMAXBFPHPZYIK-BQBZGAKWSA-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

Species Name	Source	Reference
Bitis arietans	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Oligopeptides

Alternative Parents

Substituents

Alpha-oligopeptide
Aspartic acid or derivatives
N-acyl-alpha amino acid or derivatives
N-acyl-alpha-amino acid
N-acyl-l-alpha-amino acid
Alpha-amino acid amide
N-substituted-alpha-amino acid
Alpha-amino acid or derivatives
N-acyl-amine
Fatty acyl
Fatty acid
Dicarboxylic acid or derivatives
Fatty amide
Guanidine
Secondary carboxylic acid amide
Carboxamide group
Amino acid
Amino acid or derivatives
Carboxylic acid
Organic 1,3-dipolar compound
Propargyl-type 1,3-dipolar organic compound
Carboximidamide
Organopnictogen compound
Organic oxygen compound
Organic nitrogen compound
Hydrocarbon derivative
Carbonyl group
Organic oxide
Amine
Primary aliphatic amine
Primary amine
Organooxygen compound
Organonitrogen compound
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic 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

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

94603

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

104802

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Teo YC, Park EJ, Guo J, Abbas A, Smith RAA, Goh D, Yeong JPS, Cool S, Teo P: Bioactive PCL-Peptide and PLA-Peptide Brush Copolymers for Bone Tissue Engineering. ACS Appl Bio Mater. 2022 Sep 13. doi: 10.1021/acsabm.2c00455. [PubMed:36101969 ]
Tan H, Li Y, Ma J, Wang P, Chen Q, Hu L: Hollow Mesoporous CeO(2)-Based Nanoenzymes Fabrication for Effective Synergistic Eradication of Malignant Breast Cancer via Photothermal-Chemodynamic Therapy. Pharmaceutics. 2022 Aug 17;14(8):1717. doi: 10.3390/pharmaceutics14081717. [PubMed:36015343 ]
Zhang S, Li R, Zheng Y, Zhou Y, Fan X: Erythrocyte Membrane-Enveloped Salvianolic Acid B Nanoparticles Attenuate Cerebral Ischemia-Reperfusion Injury. Int J Nanomedicine. 2022 Aug 10;17:3561-3577. doi: 10.2147/IJN.S375908. eCollection 2022. [PubMed:35974873 ]
Kitsugi K, Noritake H, Matsumoto M, Hanaoka T, Umemura M, Yamashita M, Takatori S, Ito J, Ohta K, Chida T, Ulmasov B, Neuschwander-Tetri BA, Suda T, Kawata K: Arg-Gly-Asp-binding integrins activate hepatic stellate cells via the hippo signaling pathway. Cell Signal. 2022 Nov;99:110437. doi: 10.1016/j.cellsig.2022.110437. Epub 2022 Aug 12. [PubMed:35970425 ]
Xie S, Li S, Cao W, Mo C, Zhang Z, Huang K, Li X: Bacteria-Templated and Dual Enzyme-Powered Microcapsule Motors To Promote Thrombus Penetration and Thrombolytic Efficacy. ACS Appl Mater Interfaces. 2022 Aug 24;14(33):37553-37565. doi: 10.1021/acsami.2c11213. Epub 2022 Aug 10. [PubMed:35948498 ]
LOTUS database [Link]

Showing NP-Card for (2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid (NP0307815)

MOL for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

3D MOL for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

3D SDF for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

3D-SDF for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

PDB for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

3D PDB for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

SMILES for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

INCHI for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

Structure for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)

3D Structure for NP0307815 ((2s)-2-[(2-{[(2s)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-1-hydroxyethylidene)amino]butanedioic acid)