KEGG   COMPOUND: C00542
Entry
C00542                      Compound                               
Name
Cystathionine
Formula
C7H14N2O4S
Exact mass
222.0674
Mol weight
222.2621
Structure
Reaction
R01289 R02508
Enzyme
2.5.1.48        4.2.1.22
Other DBs
CAS: 535-34-2
PubChem: 3823
ChEBI: 165853 17755
3DMET: B01284
NIKKAJI: J410.855H
KCF data

ATOM        14
            1   C1c C    19.1100  -16.5200
            2   C1b C    20.3000  -15.8200
            3   C6a C    17.8500  -15.8200
            4   N1a N    19.1100  -17.9200
            5   C1b C    21.4900  -16.5200
            6   O6a O    17.8500  -14.4200
            7   O6a O    16.6600  -16.5200
            8   S2a S    22.7500  -15.8200
            9   C1b C    23.9400  -16.5200
            10  C1c C    25.1300  -15.8200
            11  C6a C    26.3900  -16.5200
            12  N1a N    25.1300  -14.4200
            13  O6a O    27.5800  -15.8200
            14  O6a O    26.3900  -17.9200
BOND        13
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     3   7 1
            7     5   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   10  12 1
            12   11  13 1
            13   11  14 2

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Chemical substance (12)   
   PubChem (1)   
   ChEBI (2)   
   3DMET (1)   
   HMDB (1)   
   MASSBANK (6)   
   NIKKAJI (1)   
Chemical reaction (4)   
   KEGG ENZYME (2)   
   KEGG REACTION (2)   
Gene (5021)   
   KEGG GENES (5021)   
All databases (5037)   

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