COMPOUND: C20895
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Entry
C20895 Compound
Name
(2S,3S)-3-Methylphenylalanine
Formula
C10H13NO2
Exact mass
179.0946
Mol weight
179.22
Structure
Mol file
KCF file
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Reaction
R10845
Enzyme
2.6.1.57
2.6.1.107
Other DBs
PubChem:
254741358
PDB-CCD:
41H
[
PDBj
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KCF data
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ATOM 13
1 C8y C 17.4466 -16.1434
2 C8x C 17.4466 -17.5981
3 C8x C 16.1997 -18.2908
4 C8x C 15.0221 -17.5981
5 C8x C 15.0221 -16.1434
6 C8x C 16.1997 -15.4506
7 C1c C 18.6242 -15.4506
8 C1c C 19.8018 -16.1434
9 C6a C 20.9795 -15.4506
10 O6a O 22.1571 -16.1434
11 O6a O 20.9795 -14.0652
12 N1a N 19.8018 -17.5981
13 C1a C 18.6242 -14.0700
BOND 13
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 1 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 9 11 2
12 8 12 1 #Up
13 7 13 1 #Down
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