COMPOUND: C03057
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Entry
C03057 Compound
Name
2-Carboxybenzaldehyde;
Phthalaldehydic acid;
o-Formylbenzoic acid;
2-Formylbenzoic acid;
2-Formylbenzoate
Formula
C8H6O3
Exact mass
150.0317
Mol weight
150.1314
Structure
Mol file
KCF file
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Reaction
R03465
R05643
R07713
Pathway
map00624
Polycyclic aromatic hydrocarbon degradation
map01120
Microbial metabolism in diverse environments
Enzyme
1.2.1.78
4.1.2.34
Other DBs
CAS:
119-67-5
PubChem:
5957
ChEBI:
17605
3DMET:
B00532
NIKKAJI:
J95.028I
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All DBs
KCF data
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ATOM 11
1 C8y C 28.0486 -19.8842
2 C8y C 26.8141 -19.1797
3 C8x C 28.0486 -21.3064
4 C4a C 29.1932 -19.1797
5 C8x C 25.5988 -19.8842
6 C6a C 26.8075 -17.7065
7 C8x C 26.8141 -22.0238
8 C8x C 25.5988 -21.3064
9 O6a O 28.0291 -17.0018
10 O6a O 25.5859 -17.0083
11 O4a O 30.4225 -19.8441
BOND 11
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 5 8 1
8 6 9 1
9 6 10 2
10 7 8 2
11 4 11 2
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