COMPOUND: C21408
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Entry
C21408 Compound
Name
(1R,6R)-1,4,5,5a,6,9-Hexahydrophenazine-1,6-dicarboxylate
Formula
C14H14N2O4
Exact mass
274.0954
Mol weight
274.272
Structure
Mol file
KCF file
DB search
Reaction
R11489
R11493
R11569
R11570
Pathway
map00405
Phenazine biosynthesis
map01100
Metabolic pathways
map01110
Biosynthesis of secondary metabolites
Module
M00835
Pyocyanine biosynthesis, chorismate => pyocyanine
Enzyme
1.10.3.16
Other DBs
PubChem:
328082951
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KCF data
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ATOM 20
1 C2x C 15.1900 -14.4200
2 C2x C 15.1900 -13.0200
3 C1y C 14.0000 -12.3200
4 C1y C 12.7400 -13.0200
5 C2y C 12.7400 -14.4200
6 C1x C 14.0000 -15.1200
7 N1x N 11.5500 -12.3200
8 C2y C 10.3600 -13.0200
9 C2y C 10.3600 -14.4200
10 N2x N 11.5500 -15.1200
11 C1x C 9.1000 -12.3200
12 C2x C 7.9100 -13.0200
13 C2x C 7.9100 -14.4200
14 C1y C 9.1000 -15.1200
15 C6a C 14.0000 -10.9200
16 O6a O 15.1900 -10.2200
17 O6a O 12.8100 -10.2200
18 C6a C 9.1000 -16.5200
19 O6a O 7.9100 -17.2200
20 O6a O 10.2900 -17.2200
BOND 22
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 2
12 8 11 1
13 11 12 1
14 12 13 2
15 13 14 1
16 9 14 1
17 3 15 1 #Down
18 15 16 1
19 15 17 2
20 14 18 1 #Down
21 18 19 1
22 18 20 2
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