Entry |
|
Name |
Phenanthrene-4,5-dicarboxylate
|
Formula |
C16H10O4
|
Exact mass |
266.0579
|
Mol weight |
266.2482
|
Structure |
|
Reaction |
|
Pathway |
map00624 | Polycyclic aromatic hydrocarbon degradation |
map01120 | Microbial metabolism in diverse environments |
|
Enzyme |
1.6.-.- 1.13.11.- 4.1.1.-
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 20
1 C8x C 23.6036 -18.6311
2 C8x C 23.6036 -20.0319
3 C8x C 24.8167 -20.7323
4 C8y C 26.0299 -20.0319
5 C8y C 26.0299 -18.6311
6 C8y C 24.8167 -17.9307
7 C8y C 27.2430 -17.9307
8 C8y C 27.2430 -16.5299
9 C8x C 26.0299 -15.8295
10 C8x C 24.8167 -16.5299
11 C8y C 28.4561 -18.6311
12 C8x C 29.6693 -17.9307
13 C8x C 29.6693 -16.5299
14 C8x C 28.4561 -15.8295
15 C6a C 28.4660 -19.8310
16 C6a C 26.0299 -21.4319
17 O6a O 24.8302 -22.1245
18 O6a O 27.2446 -22.1333
19 O6a O 29.6930 -20.5261
20 O6a O 27.4263 -20.5249
BOND 22
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 2
8 7 8 1
9 8 9 2
10 9 10 1
11 6 10 2
12 7 11 1
13 11 12 2
14 12 13 1
15 13 14 2
16 8 14 1
17 11 15 1
18 4 16 1
19 16 17 2
20 16 18 1
21 15 19 2
22 15 20 1
|