KEGG   COMPOUND: C13454
Entry
C13454                      Compound                               
Name
Xanthoxic acid
Formula
C15H22O4
Exact mass
266.1518
Mol weight
266.33
Structure
Reaction
R06955 R06956
Pathway
map00906  Carotenoid biosynthesis
Other DBs
PubChem: 586194
ChEBI: 32303
NIKKAJI: J821.718A
KCF data

ATOM        19
            1   C1z C    22.6566  -19.4370
            2   C1z C    21.4427  -18.7366
            3   C1z C    22.6566  -20.8377
            4   C2b C    23.8706  -18.7366
            5   O2x O    23.8706  -20.1373
            6   C1x C    20.2289  -19.4370
            7   C1x C    21.4427  -21.5380
            8   C1a C    23.8706  -21.5380
            9   C2b C    25.0845  -19.4370
            10  C1y C    20.2289  -20.8377
            11  C2c C    26.2985  -18.7366
            12  O1a O    19.0150  -21.4913
            13  C2b C    27.5125  -19.4370
            14  C1a C    26.2985  -17.3359
            15  C6a C    27.5125  -20.8377
            16  O6a O    26.2985  -21.5380
            17  O6a O    28.7230  -21.5368
            18  C1a C    22.1427  -17.5242
            19  C1a C    20.4528  -17.7467
BOND        20
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     1   5 1 #Down
            5     2   6 1
            6     3   7 1
            7     3   8 1 #Up
            8     4   9 2
            9     6  10 1
            10    9  11 1
            11   10  12 1 #Up
            12   11  13 2
            13   11  14 1
            14   13  15 1
            15   15  16 2
            16    7  10 1
            17    3   5 1 #Down
            18   15  17 1
            19    2  18 1
            20    2  19 1

» Japanese version

  All links  
Pathway (1)   
   KEGG PATHWAY (1)   
Chemical substance (3)   
   PubChem (1)   
   ChEBI (1)   
   NIKKAJI (1)   
Chemical reaction (2)   
   KEGG REACTION (2)   
All databases (6)   

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