KEGG   COMPOUND: C05830Help
Entry
C05830                      Compound                               

Name
8-Methoxykynurenate;
Xanthurenic acid 8-methyl ether
Formula
C11H9NO4
Exact mass
219.0532
Mol weight
219.1935
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Tryptophan metabolism
Enzyme
2.1.1.-
Other DBs
CAS: 
2929-14-8
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        16
            1   C8y C    27.0434  -19.1946
            2   C8y C    26.9863  -17.7912
            3   C8y C    25.7633  -19.8833
            4   N5x N    28.1836  -19.9090
            5   C8y C    28.2093  -17.1026
            6   C8x C    25.7762  -17.0832
            7   C8x C    24.5534  -19.1751
            8   O2a O    25.7504  -21.2801
            9   C8y C    29.4001  -19.2203
            10  C8x C    29.4129  -17.8170
            11  O1a O    28.1965  -15.6993
            12  C8x C    24.5597  -17.7783
            13  C1a C    26.7418  -22.2649
            14  C6a C    30.6037  -19.9156
            15  O6a O    31.8138  -19.2074
            16  O6a O    30.5973  -21.3187
BOND        17
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 2
            10    5  11 1
            11    6  12 1
            12    8  13 1
            13    9  14 1
            14   14  15 1
            15   14  16 2
            16    7  12 2
            17    9  10 1

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