Marvin  05291311592D          

 19 18  0  0  1  0            999 V2000
    9.1625   -7.7036    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4481  -11.4161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5914   -7.7036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7336  -11.8286    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3059   -8.1161    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4481  -10.5910    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.8770   -8.1161    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.1625  -11.8286    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1625  -10.1785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8770   -8.9412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1625   -9.3537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5914   -6.8787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7349   -8.1161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4494   -7.7036    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0204   -7.7036    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.0204   -6.8787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7350   -6.4662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7349   -8.9412    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3060   -6.4661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  2  0  0  0  0
  2  6  1  0  0  0  0
  2  8  1  0  0  0  0
  3  7  1  0  0  0  0
  3  5  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  7  1  1  6  0  0  0
  9 11  1  0  0  0  0
 10 11  1  0  0  0  0
 12  3  2  0  0  0  0
 13 15  1  0  0  0  0
 13 14  1  0  0  0  0
 15 16  1  0  0  0  0
 15  5  1  1  0  0  0
 16 17  1  0  0  0  0
 18 13  2  0  0  0  0
 16 19  1  0  0  0  0
M  END
> <ID>
CHEBI:73823

> <NAME>
Arg-Val

> <DEFINITION>
A dipeptide formed from L-arginine and L-valine residues.

> <STAR>
3

> <SYNONYM>
RV; L-Arg-L-Val; arginylvaline; Arginyl-Valine

> <IUPAC_NAME>
L-arginyl-L-valine

> <FORMULA>
C11H23N5O3

> <MASS>
273.33200

> <MONOISOTOPIC_MASS>
273.18009

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C11H23N5O3/c1-6(2)8(10(18)19)16-9(17)7(12)4-3-5-15-11(13)14/h6-8H,3-5,12H2,1-2H3,(H,16,17)(H,18,19)(H4,13,14,15)/t7-,8-/m0/s1

> <INCHIKEY>
DAQIJMOLTMGJLO-YUMQZZPRSA-N

> <REAXYS_REGISTRY_NUMBER>
1715429

$$$$