| Entry |
|
|---|
| Name |
8-[(1R,2R)-3-Oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate;
OPC-8:0
|
|---|
| Formula |
C18H30O3
|
|---|
| Exact mass |
294.2195
|
|---|
| Mol weight |
294.429
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00592 | alpha-Linolenic acid metabolism |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00113 | Jasmonic acid biosynthesis |
|
|---|
| Enzyme |
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 21
1 C1y C 22.0807 -21.7886
2 C1y C 22.0981 -20.3873
3 C1x C 20.7436 -22.2090
4 C1b C 23.2893 -22.5067
5 C5x C 20.7669 -19.9494
6 C1b C 23.3068 -19.6866
7 C1x C 19.9379 -21.0587
8 C1b C 24.5096 -21.8177
9 O5x O 20.3932 -18.5889
10 C2b C 24.5096 -20.3990
11 C1b C 25.7066 -22.5243
12 C2b C 25.9167 -20.3990
13 C1b C 26.9326 -21.8411
14 C1b C 27.1311 -19.6924
15 C1b C 28.1296 -22.5477
16 C1a C 28.3339 -20.4047
17 C1b C 29.3499 -21.8645
18 C1b C 30.5468 -22.5768
19 C6a C 31.7729 -21.8819
20 O6a O 32.9757 -22.5942
21 O6a O 31.7671 -20.4808
BOND 21
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 4 8 1
8 5 9 2
9 6 10 1
10 8 11 1
11 10 12 2
12 11 13 1
13 12 14 1
14 13 15 1
15 14 16 1
16 15 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 19 21 2
21 5 7 1
|
|---|
