COMPOUND: C14104
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Entry
C14104 Compound
Name
cis-1,2-Dihydroxy-1,2-dihydro-7-hydroxymethylnaphthalene
Formula
C11H12O3
Exact mass
192.0786
Mol weight
192.2112
Structure
Mol file
KCF file
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Reaction
R06930
R06931
Pathway
map00626
Naphthalene degradation
map01120
Microbial metabolism in diverse environments
Enzyme
1.3.1.29
1.14.12.12
Other DBs
PubChem:
854340
NIKKAJI:
J2.787.874A
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KCF data
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ATOM 14
1 C8y C 27.0333 -16.9132
2 C8x C 27.0333 -18.3143
3 C8x C 28.2506 -19.0184
4 C8x C 28.2506 -16.2162
5 C8y C 29.4536 -16.9132
6 C8y C 29.4476 -18.3143
7 C2x C 30.6589 -19.0234
8 C2x C 31.8762 -18.3246
9 C1y C 31.8821 -16.9235
10 C1y C 30.6709 -16.2214
11 C1b C 25.8194 -16.2157
12 O1a O 24.6047 -16.9120
13 O1a O 30.6768 -14.8203
14 O1a O 33.0993 -16.2317
BOND 15
1 5 4 2
2 4 1 1
3 5 6 1
4 6 7 1
5 7 8 2
6 8 9 1
7 9 10 1
8 10 5 1
9 1 11 1
10 1 2 2
11 11 12 1
12 2 3 1
13 10 13 1 #Up
14 3 6 2
15 9 14 1 #Up
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