Mol:PBX00029

 
 OpenBabel10130914012D 
 
 14 13  0  0  0  0  0  0  0  0999 V2000 
 1155.6317-1111.1910    0.0000 N   0  0  0  0  0 
 1155.6317-1283.2957    0.0000 C   0  0  0  0  0 
 1006.5847-1369.3479    0.0000 C   0  0  0  0  0 
  857.5377-1283.2957    0.0000 O   0  0  0  0  0 
 1006.5847-1541.4525    0.0000 O   0  0  0  0  0 
 1304.6787-1369.3479    0.0000 C   0  0  0  0  0 
 1453.7256-1283.2957    0.0000 S   0  0  0  0  0 
 1602.7726-1369.3479    0.0000 S   0  0  0  0  0 
 1751.8196-1283.2957    0.0000 C   0  0  0  0  0 
 1900.8666-1369.3479    0.0000 C   0  0  0  0  0 
 1900.8666-1541.4525    0.0000 C   0  0  0  0  0 
 1751.8196-1627.5049    0.0000 O   0  0  0  0  0 
 2049.9136-1627.5049    0.0000 O   0  0  0  0  0 
 2049.9136-1283.2957    0.0000 N   0  0  0  0  0 
  1  2  1  0  0  0 
  2  3  1  0  0  0 
  2  6  1  0  0  0 
  3  4  2  0  0  0 
  3  5  1  0  0  0 
  6  7  1  0  0  0 
  7  8  1  0  0  0 
  8  9  1  0  0  0 
  9 10  1  0  0  0 
 10 11  1  0  0  0 
 10 14  1  0  0  0 
 11 12  1  0  0  0 
 11 13  2  0  0  0 
S  SKP  6 
NAME	Cystine 
ID	PBX00029 
FORMULA	C6H12N2O4S2 
EXACTMASS	240.02384826199997 
AVERAGEMASS	240.30256 
SMILES	OC(=O)C(N)CSSCC(N)C(O)=O 
M  END