COMPOUND: C11428
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Entry
C11428 Compound
Name
trans-9(S),10(S)-Dihydrodiolphenanthrene
Formula
C14H12O2
Exact mass
212.0837
Mol weight
212.2439
Structure
Mol file
KCF file
DB search
Reaction
R05658
R07708
Pathway
map00624
Polycyclic aromatic hydrocarbon degradation
map01120
Microbial metabolism in diverse environments
Enzyme
3.3.2.-
Other DBs
PubChem:
13600
ChEBI:
28951
NIKKAJI:
J88.133C
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KCF data
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ATOM 16
1 C1y C 29.4955 -18.7024
2 C1y C 30.7053 -18.0016
3 C8y C 29.4921 -15.9049
4 C8y C 30.7024 -16.6049
5 C8x C 31.9137 -15.9069
6 C8x C 31.9149 -14.5087
7 C8x C 30.7048 -13.8087
8 C8x C 29.4933 -14.5067
9 C8y C 28.2786 -18.0016
10 C8y C 28.2786 -16.5998
11 C8x C 27.0648 -15.8989
12 C8x C 25.8508 -16.5998
13 C8x C 25.8508 -18.0016
14 C8x C 27.0648 -18.7024
15 O1a O 31.9205 -18.7002
16 O1a O 29.4974 -20.1042
BOND 18
1 9 1 1
2 1 2 1
3 2 4 1
4 3 10 1
5 3 4 2
6 9 10 2
7 10 11 1
8 11 12 2
9 12 13 1
10 13 14 2
11 14 9 1
12 4 5 1
13 5 6 2
14 6 7 1
15 7 8 2
16 2 15 1 #Down
17 8 3 1
18 1 16 1 #Up
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