COMPOUND: C18281
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Entry
C18281 Compound
Name
10-Oxabenzo[def]chrysen-9-one;
9H-Pyreno[1,2-b]pyran-9-one
Formula
C19H10O2
Exact mass
270.0681
Mol weight
270.2815
Structure
Mol file
KCF file
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Reaction
R09185
Pathway
map00624
Polycyclic aromatic hydrocarbon degradation
map01120
Microbial metabolism in diverse environments
Enzyme
4.1.3.-
Other DBs
PubChem:
103061463
ChEBI:
81632
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KCF data
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ATOM 21
1 C8y C 27.2484 -19.3339
2 C8y C 28.4393 -18.6333
3 C8y C 26.0574 -18.6333
4 C8y C 27.2484 -20.7349
5 C8y C 28.4393 -17.2323
6 C8y C 29.7002 -19.3339
7 C8y C 24.8665 -19.3339
8 C8x C 26.0574 -17.2323
9 C8x C 26.0574 -21.4355
10 C8x C 28.4393 -21.4355
11 C8x C 27.2484 -16.5317
12 C8x C 29.7002 -16.5317
13 C8x C 29.7002 -20.7349
14 C8x C 30.8911 -18.6333
15 C8y C 24.8665 -20.7349
16 O7x O 23.6056 -18.6333
17 C8x C 30.8911 -17.2323
18 C8x C 23.6756 -21.4355
19 C8y C 22.4147 -19.3339
20 C8x C 22.4147 -20.7349
21 O6a O 21.1823 -18.6291
BOND 25
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 2
10 5 11 1
11 5 12 2
12 6 13 2
13 6 14 1
14 7 15 1
15 7 16 1
16 12 17 1
17 15 18 1
18 16 19 1
19 18 20 2
20 8 11 2
21 9 15 2
22 10 13 1
23 14 17 2
24 19 20 1
25 19 21 2
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