Entry |
|
Name |
|
Formula |
C20H32
|
Exact mass |
272.2504
|
Mol weight |
272.47
|
Structure |
|
Reaction |
|
Pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Enzyme |
|
Brite |
Lipids [BR:br08002]
PR Prenol lipids
PR01 Isoprenoids
PR0104 C20 isoprenoids (diterpenes)
PR010412 Podocarpane diterpenoids
C18226 ent-Cassa-12,15-diene
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 20
1 C1x C 19.6394 -19.1106
2 C1x C 19.6394 -20.4991
3 C1z C 20.8417 -21.1932
4 C1y C 22.0442 -20.4991
5 C1z C 22.0442 -19.1106
6 C1x C 20.8417 -18.4165
7 C1x C 23.2465 -21.1932
8 C1x C 24.4488 -20.4991
9 C1y C 24.4488 -19.1106
10 C1y C 23.2465 -18.4165
11 C1y C 25.6512 -18.4165
12 C2y C 25.6512 -17.0281
13 C2x C 24.4488 -16.3339
14 C1x C 23.2465 -17.0281
15 C2b C 26.8741 -16.3218
16 C2a C 28.0703 -17.0123
17 C1a C 26.8536 -19.1106
18 C1a C 22.0442 -17.7223
19 C1a C 21.2041 -22.5455
20 C1a C 19.8518 -22.1831
BOND 22
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 2
15 13 14 1
16 10 14 1
17 12 15 1
18 15 16 2
19 11 17 1 #Up
20 5 18 1 #Down
21 3 19 1
22 3 20 1
|