COMPOUND: C21397
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Entry
C21397 Compound
Name
Ethylenediamine-N,N'-diacetic acid;
Ethylenediaminediacetate;
EDDA
Formula
C6H12N2O4
Exact mass
176.0797
Mol weight
176.17
Structure
Mol file
KCF file
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Reaction
R11455
R11456
Enzyme
1.14.14.33
Other DBs
CAS:
5657-17-0
PubChem:
328082940
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KCF data
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ATOM 12
1 N1b N 16.8460 -15.7975
2 C1b C 18.0344 -15.0985
3 C1b C 15.5878 -15.0985
4 C1b C 19.2926 -15.7975
5 C6a C 15.5878 -13.7005
6 N1b N 20.4809 -15.0985
7 O6a O 14.3995 -13.0015
8 O6a O 16.8460 -13.0015
9 C1b C 21.6692 -15.7975
10 C6a C 21.6692 -17.1955
11 O6a O 22.8575 -17.8946
12 O6a O 20.4809 -17.8946
BOND 11
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 1
6 5 7 1
7 5 8 2
8 6 9 1
9 9 10 1
10 10 11 1
11 10 12 2
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