NP-MRD: Showing NP-Card for Histidyltryptophan (NP0136505)

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Record Information

Version

2.0

Created at

2022-05-12 15:16:15 UTC

Updated at

2022-05-12 15:16:15 UTC

NP-MRD ID

NP0136505

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Histidyltryptophan

Description

His-Trp, also known as HW or L-his-L-TRP, belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. His-Trp is a very strong basic compound (based on its pKa). A dipeptide formed from L-histidine and L-tryptophan residues.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 44 46  0  0  0  0  0  0  0  0999 V2000
    3.7422   -0.1582   -1.3161 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9615   -0.2646   -0.1221 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5784    0.5579    0.9974 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9471    0.0331    1.2381 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2716   -0.9804    2.1235 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6029   -1.1862    2.0775 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0904   -0.3239    1.1875 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1023    0.4267    0.6653 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5660    0.1477   -0.3889 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2367    0.5049   -1.5460 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5835    0.1520    0.6269 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7952    0.5602    0.3630 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.6624   -0.6204    0.7425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1093   -0.3475    0.5205 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0895   -0.0445    1.4396 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2514    0.1253    0.7872 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0942   -0.0517   -0.5402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9589    0.0076   -1.6220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5112   -0.2271   -2.9046 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1731   -0.5233   -3.0769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3179   -0.5810   -1.9989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7583   -0.3457   -0.6989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1433    1.7772    1.1242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3047    2.3103    1.8625 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4089    2.2984    0.9943 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4276    0.6435   -1.2255 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2397   -1.0400   -1.5904 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9148   -1.3083    0.2397 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9835    0.3731    1.9361 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6098    1.6356    0.7695 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5485   -1.5081    2.7417 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0823   -1.9083    2.6646 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1385   -0.2202    0.9034 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8464   -0.1423    1.5881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9096    0.8254   -0.7045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3753   -1.4580    0.0748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4793   -0.9529    1.7804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8981    0.0327    2.5140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1534    0.3629    1.2547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0073    0.2385   -1.5010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1853   -0.1830   -3.7646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7788   -0.7158   -4.0781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2530   -0.8124   -2.0968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8552    2.8908    1.6861 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  2  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 12 23  1  0
 23 25  1  0
 23 24  2  0
  8  4  1  0
 22 14  1  0
 22 17  1  0
  1 26  1  0
  1 27  1  0
  2 28  1  1
  3 29  1  0
  3 30  1  0
  5 31  1  0
  6 32  1  0
  7 33  1  0
 11 34  1  0
 12 35  1  6
 13 36  1  0
 13 37  1  0
 15 38  1  0
 16 39  1  0
 18 40  1  0
 19 41  1  0
 20 42  1  0
 21 43  1  0
 25 44  1  0
M  END


  Mrv1652304062013502D          

 25 27  0  0  0  0            999 V2000
 9998.880610000.2013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9999.5954 9999.7892    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10000.309310000.2013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.0248 9999.7892    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
10001.742510000.2013    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10002.4560 9999.7892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10003.171610000.2013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10000.309310001.0261    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.5954 9998.9638    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9997.494910000.2836    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9996.8275 9999.7986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.0824 9999.0140    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9997.9074 9999.0140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9998.1623 9999.7986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.743510001.0263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.458510001.4379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.029610001.4397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.9253 9999.8658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10004.477310000.4788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10004.064810001.1933    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
10003.257910001.0218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10004.1802 9999.0811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10004.9871 9998.9094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10005.5392 9999.5225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10005.284310000.3072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  9  1  1  0  0  0
  3  4  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
 13 14  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 10 11  2  0  0  0  0
 10 14  1  0  0  0  0
  1 14  1  0  0  0  0
  5 15  1  6  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
  6  7  1  0  0  0  0
 18 19  1  0  0  0  0
  7 18  1  0  0  0  0
  7 21  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 18 22  2  0  0  0  0
 25 19  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0136505

> <DATABASE_NAME>
NP-MRD

> <SMILES>
N[C@@H](CC1=CNC=N1)C(=O)N[C@@H](CC1=CNC2=CC=CC=C12)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C17H19N5O3/c18-13(6-11-8-19-9-21-11)16(23)22-15(17(24)25)5-10-7-20-14-4-2-1-3-12(10)14/h1-4,7-9,13,15,20H,5-6,18H2,(H,19,21)(H,22,23)(H,24,25)/t13-,15-/m0/s1

> <INCHI_KEY>
FBTYOQIYBULKEH-ZFWWWQNUSA-N

> <FORMULA>
C17H19N5O3

> <MOLECULAR_WEIGHT>
341.371

> <EXACT_MASS>
341.148789492

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
44

> <JCHEM_AVERAGE_POLARIZABILITY>
34.601271927930284

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
5

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanoic acid

> <ALOGPS_LOGP>
-0.92

> <JCHEM_LOGP>
-1.9975924916907446

> <ALOGPS_LOGS>
-3.14

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.915272755277236

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.616778417606598

> <JCHEM_PKA_STRONGEST_BASIC>
7.83853606828442

> <JCHEM_POLAR_SURFACE_AREA>
136.89000000000001

> <JCHEM_REFRACTIVITY>
90.49620000000003

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.47e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 06-APR-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-APR-20         0                                  
HETATM    1  C   UNK     0    8664.5778667.042   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0    8665.9118666.273   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0    8667.2448667.042   0.000  0.00  0.00           C+0
HETATM    4  N   UNK     0    8668.5808666.273   0.000  0.00  0.00           N+0
HETATM    5  C   UNK     0    8669.9198667.042   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0    8671.2518666.273   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0    8672.5878667.042   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0    8667.2448668.582   0.000  0.00  0.00           O+0
HETATM    9  N   UNK     0    8665.9118664.732   0.000  0.00  0.00           N+0
HETATM   10  N   UNK     0    8661.9908667.196   0.000  0.00  0.00           N+0
HETATM   11  C   UNK     0    8660.7458666.291   0.000  0.00  0.00           C+0
HETATM   12  N   UNK     0    8661.2208664.826   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0    8662.7608664.826   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0    8663.2368666.291   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0    8669.9218668.582   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0    8671.2568669.351   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0    8668.5898669.354   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0    8673.9948666.416   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0    8675.0248667.560   0.000  0.00  0.00           C+0
HETATM   20  N   UNK     0    8674.2548668.894   0.000  0.00  0.00           N+0
HETATM   21  C   UNK     0    8672.7488668.574   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0    8674.4708664.951   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0    8675.9768664.631   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0    8677.0078665.775   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0    8676.5318667.240   0.000  0.00  0.00           C+0
CONECT    1    2   14                                                       
CONECT    2    1    3    9                                                  
CONECT    3    2    4    8                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6   15                                                  
CONECT    6    5    7                                                       
CONECT    7    6   18   21                                                  
CONECT    8    3                                                            
CONECT    9    2                                                            
CONECT   10   11   14                                                       
CONECT   11   12   10                                                       
CONECT   12   11   13                                                       
CONECT   13   14   12                                                       
CONECT   14   13   10    1                                                  
CONECT   15    5   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15                                                            
CONECT   18   19    7   22                                                  
CONECT   19   18   20   25                                                  
CONECT   20   19   21                                                       
CONECT   21    7   20                                                       
CONECT   22   23   18                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   19                                                       
MASTER        0    0    0    0    0    0    0    0   25    0   54    0
END

View in JSmol

Synonyms

Value	Source
Histidinyl-tryptophan	ChEBI
Histidyltryptophan	ChEBI
HW	ChEBI
L-His-L-TRP	ChEBI
H-W dipeptide	HMDB
HW dipeptide	HMDB
His-Trp	HMDB
Histidine tryptophan dipeptide	HMDB
Histidine-tryptophan dipeptide	HMDB
Histidinyltryptophan	HMDB
Histidyl-tryptophan	HMDB
L-Histidinyl-L-tryptophan	HMDB
L-Histidyl-L-tryptophan	HMDB
N-Histidinyltryptophan	HMDB
N-Histidyltryptophan	HMDB
N-L-Histidinyl-L-tryptophan	HMDB
N-L-Histidyl-L-tryptophan	HMDB

Chemical Formula

C₁₇H₁₉N₅O₃

Average Mass

341.3710 Da

Monoisotopic Mass

341.14879 Da

IUPAC Name

(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanoic acid

Traditional Name

(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanoic acid

CAS Registry Number

Not Available

SMILES

N[C@@H](CC1=CNC=N1)C(=O)N[C@@H](CC1=CNC2=CC=CC=C12)C(O)=O

InChI Identifier

InChI=1S/C17H19N5O3/c18-13(6-11-8-19-9-21-11)16(23)22-15(17(24)25)5-10-7-20-14-4-2-1-3-12(10)14/h1-4,7-9,13,15,20H,5-6,18H2,(H,19,21)(H,22,23)(H,24,25)/t13-,15-/m0/s1

InChI Key

FBTYOQIYBULKEH-ZFWWWQNUSA-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

Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Dipeptides

Alternative Parents

Substituents

Alpha-dipeptide
Histidine or derivatives
N-acyl-alpha-amino acid
N-acyl-alpha amino acid or derivatives
N-acyl-l-alpha-amino acid
Alpha-amino acid amide
Indolyl carboxylic acid derivative
Alpha-amino acid or derivatives
3-alkylindole
Indole
Indole or derivatives
Imidazolyl carboxylic acid derivative
Aralkylamine
Fatty acyl
Fatty amide
Benzenoid
Substituted pyrrole
Imidazole
Azole
Pyrrole
Heteroaromatic compound
Secondary carboxylic acid amide
Carboxylic acid salt
Carboxamide group
Amino acid
Amino acid or derivatives
Azacycle
Carboxylic acid
Organoheterocyclic compound
Monocarboxylic acid or derivatives
Primary amine
Organic zwitterion
Organic salt
Amine
Organic oxygen compound
Organic nitrogen compound
Hydrocarbon derivative
Carbonyl group
Organic oxide
Organooxygen compound
Organonitrogen compound
Primary aliphatic amine
Organopnictogen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

dipeptide (CHEBI:74058 )

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	-0.92	ALOGPS
logP	-2	ChemAxon
logS	-3.1	ALOGPS
pKa (Strongest Acidic)	3.62	ChemAxon
pKa (Strongest Basic)	7.84	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	5	ChemAxon
Polar Surface Area	136.89 Å²	ChemAxon
Rotatable Bond Count	7	ChemAxon
Refractivity	90.5 m³·mol⁻¹	ChemAxon
Polarizability	34.6 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

External Links

HMDB ID

HMDB0028896

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

5373229

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

7009649

PDB ID

Not Available

ChEBI ID

74058

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Histidyltryptophan (NP0136505)

MOL for NP0136505 (Histidyltryptophan)

3D MOL for NP0136505 (Histidyltryptophan)

3D SDF for NP0136505 (Histidyltryptophan)

3D-SDF for NP0136505 (Histidyltryptophan)

PDB for NP0136505 (Histidyltryptophan)

3D PDB for NP0136505 (Histidyltryptophan)

SMILES for NP0136505 (Histidyltryptophan)

INCHI for NP0136505 (Histidyltryptophan)

Structure for NP0136505 (Histidyltryptophan)

3D Structure for NP0136505 (Histidyltryptophan)