Ketcher 03241612192D 1   1.00000     0.00000     0

 17 16  0     1  0            999 V2000
   10.9974   -8.0044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9974   -9.0051    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1309   -7.5040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8642   -7.5040    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2642   -8.0044    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.1309   -6.5033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5973   -7.5040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5973   -6.5033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7307   -8.0044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4638   -8.0044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7307   -9.0051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5973   -9.5054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5973  -10.5061    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.4639  -11.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9949   -5.9999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9949   -4.9999    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.8609   -4.4999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0     0  0
  3  1  1  0     0  0
  4  1  1  0     0  0
  3  5  1  1     0  0
  6  3  1  0     0  0
  8  7  2  0     0  0
  9  7  1  0     0  0
 10  7  1  0     0  0
  9  4  1  6     0  0
 11  9  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
  6 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
M  END
> <ID>
CHEBI:74707

> <NAME>
Met-Met

> <DEFINITION>
A dipeptide formed from two L-methionine residues.

> <STAR>
3

> <SYNONYM>
MM; methionylmethionine; Methionyl-Methionine; L-Met-L-Met; H-Met-Met-OH; H-L-Met-L-Met-OH

> <IUPAC_NAME>
L-methionyl-L-methionine

> <FORMULA>
C10H20N2O3S2

> <MASS>
280.410

> <MONOISOTOPIC_MASS>
280.09153

> <CHARGE>
0

> <SMILES>
C(=O)([C@@H](N)CCSC)N[C@H](C(=O)O)CCSC

> <INCHI>
InChI=1S/C10H20N2O3S2/c1-16-5-3-7(11)9(13)12-8(10(14)15)4-6-17-2/h7-8H,3-6,11H2,1-2H3,(H,12,13)(H,14,15)/t7-,8-/m0/s1

> <INCHIKEY>
ZYTPOUNUXRBYGW-YUMQZZPRSA-N

> <REAXYS_REGISTRY_NUMBER>
1728608

$$$$