| Entry |
|
|---|
| Name |
Costunolide;
(+)-Costunolide
|
|---|
| Formula |
C15H20O2
|
|---|
| Exact mass |
232.1463
|
|---|
| Mol weight |
232.3181
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00909 | Sesquiterpenoid and triterpenoid biosynthesis |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Enzyme |
|
|---|
| Brite |
Phytochemical compounds [BR:br08003]
Terpenoids
Sesquiterpenoids (C15)
Germacrenes
C09382 Costunolide
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 17
1 C1y C 24.5787 -15.5441
2 C1y C 25.9761 -15.5096
3 O7x O 24.1090 -16.8671
4 C2x C 23.7207 -14.4973
5 C2y C 26.3824 -16.9212
6 C1x C 26.8734 -14.4951
7 C7x C 25.2274 -17.7168
8 C2y C 22.3217 -14.5120
9 C2a C 27.6954 -17.3853
10 C1x C 26.5994 -13.1216
11 O6a O 25.1919 -19.1143
12 C1x C 21.8112 -13.2112
13 C1a C 21.5732 -15.6885
14 C2y C 25.3481 -12.4916
15 C1x C 22.8854 -12.3222
16 C2x C 24.0669 -13.0737
17 C1a C 25.3057 -11.0963
BOND 18
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 2
8 5 9 2
9 6 10 1
10 7 11 2
11 8 12 1
12 8 13 1
13 10 14 1
14 12 15 1
15 14 16 2
16 14 17 1
17 5 7 1
18 15 16 1
|
|---|
