KEGG   RPAIR: RP04839Help
Entry
RP04839                     RPair                                  

Name
C06613_C06614
Compound
C06613  
trans-3-Chloroallyl aldehyde
C06614  
trans-3-Chloroacrylic acid
Type
main
RDM
1
1     C4a-C6a:*-O6a:C2b+O4a-C2b+O6a
RClass
Related pair
Reaction
Enzyme
KCF data Show

ALIGN       5
            1     1:C2b   1:C2b #M1
            2     2:C4a   2:C6a #R1
            3     3:C2b   3:C2b
            4     4:O4a   5:O6a #M1
            5     5:X     6:X  
            -       *     4:O6a #D1
ENTRY1      
 COMPOUND  C06613
 ATOM      5
            1   C2b C     0.0000   -0.1655
            2   C4a C     0.7172    0.2483
            3   C2b C    -0.7172    0.2448
            4   O4a O     1.4345   -0.1586
            5   X   Cl   -1.4345   -0.1690
 BOND      4
            1     1   2 1
            2     1   3 2
            3     2   4 2
            4     3   5 1
ENTRY2      
 COMPOUND  C06614
 ATOM      6
            1   C2b C    -0.1207   -0.3414
            2   C6a C     0.5966    0.0690
            3   C2b C    -0.8345    0.0655
            4   O6a O     1.3138   -0.3379
            5   O6a O     0.5966    0.8931
            6   X   Cl   -1.5517   -0.3483
 BOND      5
            1     1   2 1
            2     1   3 2
            3     2   4 1
            4     2   5 2
            5     3   6 1

DBGET integrated database retrieval system