COMPOUND: C21896
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Entry
C21896 Compound
Name
2,4-Diacetylphloroglucinol
Formula
C10H10O5
Exact mass
210.0528
Mol weight
210.18
Structure
Mol file
KCF file
DB search
Reaction
R12087
R12392
Enzyme
2.3.1.272
3.7.1.24
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KCF data
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ATOM 15
1 C8y C 16.7979 -17.5711
2 C8y C 16.7979 -16.1654
3 C8x C 18.0630 -18.2739
4 O1a O 15.6031 -18.2739
5 C8y C 18.0630 -15.4626
6 C8y C 19.2578 -17.5711
7 C8y C 19.2578 -16.1654
8 O1a O 18.0630 -14.0569
9 O1a O 20.4527 -18.2739
10 C5a C 20.4527 -15.4626
11 C1a C 21.6475 -16.0951
12 O5a O 20.4527 -14.0569
13 C5a C 15.5949 -15.4575
14 C1a C 14.3830 -16.1441
15 O5a O 15.6064 -14.0700
BOND 15
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 5 7 1
7 5 8 1
8 6 9 1
9 6 7 2
10 7 10 1
11 10 11 1
12 10 12 2
13 2 13 1
14 13 14 1
15 13 15 2
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