COMPOUND: C22455
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Entry
C22455 Compound
Name
3-Amino-2,4-dihydroxybenzoate;
3-Amino-2,4-dihydroxybenzoic acid
Formula
C7H7NO4
Exact mass
169.0375
Mol weight
169.13
Structure
Mol file
KCF file
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Reaction
R12912
R12928
Pathway
map00998
Biosynthesis of various antibiotics
map01100
Metabolic pathways
map01110
Biosynthesis of secondary metabolites
Module
M00951
Cremeomycin biosynthesis, aspartate/3,4-AHBA => cremeomycin
Enzyme
1.14.13.249
2.1.1.380
Other DBs
PubChem:
497619814
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KCF data
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ATOM 12
1 C8x C 16.8121 -15.1239
2 C8x C 16.8121 -16.5308
3 C8y C 18.0079 -17.2342
4 C8y C 19.2038 -16.5308
5 C8y C 19.2038 -15.1239
6 C8y C 18.0079 -14.4205
7 O1a O 18.0079 -13.0136
8 N1a N 20.4699 -14.4205
9 C6a C 18.0079 -18.6410
10 O6a O 19.2038 -19.3444
11 O6a O 16.8121 -19.3444
12 O1a O 20.4162 -17.2308
BOND 12
1 5 6 2
2 6 1 1
3 6 7 1
4 1 2 2
5 5 8 1
6 2 3 1
7 3 9 1
8 3 4 2
9 9 10 1
10 4 5 1
11 9 11 2
12 4 12 1
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