COMPOUND: C06356
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Entry
C06356 Compound
Name
2,4,6-Trihydroxybenzophenone;
Phenyl(2,4,6-trihydroxyphenyl)-methanone
Formula
C13H10O4
Exact mass
230.0579
Mol weight
230.2161
Structure
Mol file
KCF file
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Reaction
R02447
Enzyme
2.3.1.220
Other DBs
CAS:
3555-86-0
PubChem:
8592
ChEBI:
28233
3DMET:
B00950
NIKKAJI:
J216.197D
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KCF data
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ATOM 17
1 C8y C 27.5634 -18.9355
2 C5a C 28.7812 -18.2362
3 C8y C 27.5634 -20.3339
4 C8y C 26.3573 -18.2362
5 C8y C 29.9931 -18.9355
6 O5a O 28.7812 -16.8379
7 C8x C 26.3573 -21.0390
8 O1a O 28.7753 -21.0331
9 C8x C 25.1394 -18.9355
10 O1a O 26.3573 -16.8437
11 C8x C 29.9874 -20.3339
12 C8x C 31.2052 -18.2362
13 C8y C 25.1394 -20.3339
14 C8x C 31.1993 -21.0390
15 C8x C 32.4171 -18.9355
16 O1a O 23.9275 -21.0331
17 C8x C 32.4171 -20.3398
BOND 18
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 2
11 5 12 1
12 7 13 1
13 11 14 1
14 12 15 2
15 13 16 1
16 14 17 2
17 9 13 2
18 15 17 1
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