KEGG   COMPOUND: C14109
Entry
C14109                      Compound                               

Name
4-Hydroxymethylsalicylate;
2-Hydroxy-4-hydroxymethylbenzoic acid
Formula
C8H8O4
Exact mass
168.0423
Mol weight
168.1467
Structure
Reaction
Pathway
map00626  Naphthalene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.2.1.-         1.14.13.1
Other DBs
CAS: 106420-93-3
PubChem: 854345
ChEBI: 20415
NIKKAJI: J2.787.883K
LinkDB
KCF data

ATOM        12
            1   C8y C    26.7660  -18.1220
            2   C8x C    26.7660  -19.5226
            3   C8x C    27.9819  -20.2229
            4   C8x C    27.9819  -17.4217
            5   C8y C    29.1906  -18.1220
            6   C8y C    29.1847  -19.5226
            7   C6a C    30.3947  -20.2282
            8   O1a O    30.4067  -17.4269
            9   C1b C    25.5535  -17.4212
            10  O1a O    24.3401  -18.1208
            11  O6a O    31.6106  -19.5329
            12  O6a O    30.3887  -21.6288
BOND        12
            1     2   3 1
            2     3   6 2
            3     5   6 1
            4     6   7 1
            5     8   5 1
            6     5   4 2
            7     1   9 1
            8     4   1 1
            9     9  10 1
            10    7  11 1
            11    1   2 2
            12    7  12 2

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