COMPOUND: C06721
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Entry
C06721 Compound
Name
cis-1,2-Dihydroxy-1,2-dihydrodibenzothiophene
Formula
C12H10O2S
Exact mass
218.0402
Mol weight
218.2716
Structure
Mol file
KCF file
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Reaction
R05310
Enzyme
1.3.1.60
Other DBs
PubChem:
8944
ChEBI:
16941
182624
NIKKAJI:
J2.763.685C
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KCF data
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ATOM 15
1 C8y C 28.6127 -16.9809
2 C8y C 29.9131 -17.4474
3 C8y C 28.6301 -15.5520
4 C1y C 27.4288 -17.6748
5 C8y C 30.7354 -16.3161
6 C8x C 30.4497 -18.7713
7 S2x S 29.9423 -15.1379
8 C2x C 27.4404 -14.8171
9 C1y C 26.2506 -16.9342
10 O1a O 27.4345 -19.1095
11 C8x C 32.1001 -16.5026
12 C8x C 31.8144 -18.9578
13 C2x C 26.2565 -15.5053
14 O1a O 25.0493 -17.6341
15 C8x C 32.6367 -17.8149
BOND 17
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 4 10 1 #Down
10 5 11 1
11 6 12 2
12 8 13 2
13 9 14 1 #Down
14 11 15 2
15 5 7 1
16 9 13 1
17 12 15 1
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