COMPOUND: C20961
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Entry
C20961 Compound
Name
N3-Fumaroyl-L-2,3-diaminopropanoate;
N3-Fumaroyl-(S)-2,3-diaminopropanoate;
(2E)-4-{[(2S)-2-Amino-2-carboxyethyl]amino}-4-oxobut-2-enoate
Formula
C7H10N2O5
Exact mass
202.059
Mol weight
202.1647
Structure
Mol file
KCF file
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Reaction
R10940
R12352
Pathway
map00998
Biosynthesis of various antibiotics
map01100
Metabolic pathways
map01110
Biosynthesis of secondary metabolites
Module
M00904
Dapdiamides biosynthesis, L-2,3-diaminopropanoate => dapdiamide A/B/C
Enzyme
6.3.2.46
6.3.5.-
Other DBs
PubChem:
254741422
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KCF data
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ATOM 14
1 O6a O 10.1724 -14.2100
2 C6a C 11.3849 -13.5100
3 C2b C 12.5973 -14.2100
4 C2b C 13.8097 -13.5100
5 C5a C 15.0222 -14.2100
6 N1b N 16.2346 -13.5100
7 O6a O 11.3849 -12.1102
8 O5a O 15.0222 -15.6097
9 C1b C 17.4524 -14.2100
10 C1c C 18.6649 -13.5100
11 C6a C 19.8773 -14.2100
12 O6a O 21.0897 -13.5100
13 N1a N 18.6649 -12.1102
14 O6a O 19.8773 -15.6100
BOND 13
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 2 7 2
7 5 8 2
8 6 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 10 13 1 #Down
13 11 14 2
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