KEGG   COMPOUND: C05645
Entry
C05645                      Compound                               
Name
4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoate
Formula
C10H9NO5
Exact mass
223.0481
Mol weight
223.1822
Structure
Reaction
R03954 R04171 R12694
Pathway
map00380  Tryptophan metabolism
Enzyme
2.6.1.7         2.6.1.63
Other DBs
PubChem: 7956
ChEBI: 27593
3DMET: B00823
NIKKAJI: J2.756.639A
LinkDB
KCF data

ATOM        16
            1   C8y C    23.2905  -16.5613
            2   C8y C    23.2905  -17.9677
            3   C5a C    24.5048  -15.8513
            4   C8x C    22.0728  -15.8546
            5   C8y C    22.0728  -18.6743
            6   N1a N    24.2990  -18.7567
            7   C1b C    25.7260  -16.5545
            8   O5a O    24.5014  -14.4414
            9   C8x C    20.8550  -16.5613
            10  C8x C    20.8550  -17.9677
            11  O1a O    22.0660  -20.0841
            12  C5a C    26.9437  -15.8478
            13  C6a C    28.1614  -16.5510
            14  O5a O    26.9403  -14.4380
            15  O6a O    28.1614  -17.9574
            16  O6a O    29.3826  -15.8478
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    7  12 1
            12   12  13 1
            13   12  14 2
            14   13  15 2
            15   13  16 1
            16    9  10 2

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