KEGG   COMPOUND: C05585
Entry
C05585                      Compound                               
Name
Gentisate aldehyde;
2,5-Dihydroxybenzaldehyde
Formula
C7H6O3
Exact mass
138.0317
Mol weight
138.1207
Structure
Reaction
Pathway
map00350  Tyrosine metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
1.2.1.29        1.2.3.1         1.13.12.-       4.1.1.-
Other DBs
PubChem: 7911
ChEBI: 28508
3DMET: B00799
NIKKAJI: J7.451I
LinkDB
KCF data

ATOM        10
            1   C8x C    17.8500  -23.0300
            2   C8y C    17.8500  -24.4300
            3   C8x C    19.0624  -25.1300
            4   C8x C    20.2749  -24.4300
            5   C8y C    20.2749  -23.0300
            6   C8y C    19.0624  -22.3300
            7   O1a O    16.6376  -25.1300
            8   O1a O    21.5060  -22.3190
            9   C4a C    19.0624  -20.9302
            10  O4a O    17.8332  -20.2203
BOND        10
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     2   7 1
            8     5   8 1
            9     6   9 1
            10    9  10 2

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