COMPOUND: C04204
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Entry
C04204 Compound
Name
N-(2,3-Dihydroxybenzoyl)-L-serine;
2,3-Dihydroxy-N-benzoyl-L-serine;
2,3-Dihydroxybenzoylserine
Formula
C10H11NO6
Exact mass
241.0586
Mol weight
241.1974
Structure
Mol file
KCF file
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CAS:
7724-78-9
PubChem:
6877
ChEBI:
17455
PDB-CCD:
DBS
[
PDBj
]
NIKKAJI:
J647.927H
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KCF data
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ATOM 17
1 C8y C 23.8027 -18.5942
2 C8y C 25.0131 -19.2848
3 C5a C 23.8027 -17.2184
4 C8x C 22.6170 -19.2848
5 C8y C 25.0131 -20.6781
6 O1a O 26.2059 -18.5942
7 N1b N 25.2075 -16.4565
8 O5a O 22.6041 -16.5276
9 C8x C 22.6170 -20.6781
10 C8x C 23.8027 -21.3804
11 O1a O 26.2118 -21.3630
12 C1c C 25.2075 -15.0565
13 C6a C 26.4124 -14.3500
14 O6a O 27.6249 -15.0500
15 C1b C 23.9876 -14.3500
16 O1a O 22.7751 -15.0500
17 O6a O 26.4077 -12.9501
BOND 17
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 1
9 5 10 1
10 5 11 1
11 9 10 2
12 12 7 1 #Up
13 12 13 1
14 13 14 1
15 12 15 1
16 15 16 1
17 13 17 2
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