COMPOUND: C17745
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Entry
C17745 Compound
Name
1-(3,4-Dihydroxyphenyl)-1-decene-3,5-dione
Formula
C16H20O4
Exact mass
276.1362
Mol weight
276.3276
Structure
Mol file
KCF file
DB search
Reaction
R08799
R08801
R08803
Pathway
map00945
Stilbenoid, diarylheptanoid and gingerol biosynthesis
map01110
Biosynthesis of secondary metabolites
Enzyme
2.1.1.-
Other DBs
PubChem:
96024072
ChEBI:
181365
81310
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All DBs
KCF data
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ATOM 20
1 C8y C 25.4100 -28.7700
2 C8y C 25.4100 -30.1700
3 C8x C 26.6000 -30.8700
4 C8x C 27.7900 -30.1700
5 C8y C 27.7900 -28.7700
6 C8x C 26.6000 -28.0700
7 O1a O 24.2200 -30.8700
8 C2b C 29.0500 -28.0700
9 C2b C 30.2400 -28.7700
10 C5a C 31.5000 -28.0700
11 C2b C 32.6900 -28.7700
12 C2c C 33.8800 -28.0700
13 C1b C 35.1400 -28.7700
14 C1b C 36.3300 -28.0700
15 C1b C 37.5200 -28.7700
16 C1b C 38.7800 -28.0700
17 C1a C 39.9700 -28.7700
18 O5a O 31.5000 -26.6700
19 O1a O 33.8800 -26.6700
20 O1a O 24.1947 -28.0749
BOND 20
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 2 7 1
8 5 8 1
9 8 9 2
10 9 10 1
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 10 18 2
19 12 19 1
20 1 20 1
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