Marvin  06031315462D          

 11 10  0  0  1  0            999 V2000
    6.4925   -4.5081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4925   -5.3331    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7780   -4.0956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2070   -4.0956    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0634   -4.5081    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6362   -4.0956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9215   -5.3331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9218   -4.5081    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.6362   -3.2703    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3506   -4.5081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6361   -5.7456    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  3  5  1  0  0  0  0
  8  6  1  0  0  0  0
  9  6  2  0  0  0  0
 10  6  1  0  0  0  0
  8  7  1  0  0  0  0
  8  4  1  6  0  0  0
  7 11  1  0  0  0  0
M  END
> <ID>
CHEBI:73890

> <NAME>
Gly-Cys

> <DEFINITION>
A dipeptide formed from glycine and L-cysteine residues.

> <STAR>
3

> <SYNONYM>
glycylcysteine; Glycyl-Cysteine; Gly-L-Cys; GC

> <IUPAC_NAME>
glycyl-L-cysteine

> <FORMULA>
C5H10N2O3S

> <MASS>
178.21000

> <MONOISOTOPIC_MASS>
178.04121

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C5H10N2O3S/c6-1-4(8)7-3(2-11)5(9)10/h3,11H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1

> <INCHIKEY>
MFBYPDKTAJXHNI-VKHMYHEASA-N

> <REAXYS_REGISTRY_NUMBER>
1709363

$$$$