| Entry |
|
|---|
| Name |
Solasodine;
(3beta,22alpha,25R)-Spirosol-5-en-3-ol
|
|---|
| Formula |
C27H43NO2
|
|---|
| Exact mass |
413.3294
|
|---|
| Mol weight |
413.6358
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01066 | Biosynthesis of alkaloids derived from terpenoid and polyketide |
|
|---|
| Brite |
Lipids [BR:br08002]
ST Sterol lipids
ST01 Sterols
ST0115 Solanidines and alkaloid derivatives
C10822 Solasodine
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived by amination reactions
Steroid alkaloids
C10822 Solasodine
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 30
1 C1y C 27.7443 -19.9261
2 C1y C 28.8979 -20.5961
3 C1y C 27.7501 -18.5832
4 C1x C 28.9329 -21.9317
5 O2x O 30.0357 -19.9318
6 C1z C 30.0415 -18.5832
7 C1a C 26.7920 -17.6450
8 C1x C 31.1964 -19.2604
9 N1x N 30.0415 -17.2604
10 C1x C 32.3455 -18.5832
11 C1x C 31.2023 -16.6018
12 C1y C 32.3572 -17.2661
13 C1a C 33.5124 -16.6018
14 C1y C 26.5646 -21.9031
15 C1z C 26.5646 -20.5723
16 C1x C 25.4027 -19.8416
17 C1y C 25.3794 -22.5651
18 C1x C 24.2119 -20.5093
19 C1y C 24.2002 -21.8741
20 C1x C 25.3794 -23.9294
21 C1z C 23.0221 -22.5534
22 C2x C 24.1885 -24.6089
23 C2y C 23.0162 -23.9179
24 C1x C 21.8441 -21.8681
25 C1a C 23.0105 -21.1888
26 C1x C 21.8441 -24.6030
27 C1x C 20.6588 -22.5534
28 C1y C 20.6588 -23.9179
29 O1a O 19.4679 -24.6030
30 C1a C 26.4996 -19.1637
BOND 35
1 15 1 1
2 1 2 1
3 1 3 1
4 14 4 1
5 2 5 1
6 3 6 1
7 3 7 1 #Down
8 6 8 1 #Up
9 6 9 1 #Down
10 8 10 1
11 9 11 1
12 10 12 1
13 12 13 1 #Down
14 2 4 1
15 5 6 1
16 11 12 1
17 14 17 1
18 16 18 1
19 17 19 1
20 17 20 1
21 19 21 1
22 20 22 1
23 21 23 1
24 21 24 1
25 21 25 1 #Up
26 23 26 1
27 24 27 1
28 26 28 1
29 28 29 1 #Up
30 18 19 1
31 22 23 2
32 27 28 1
33 15 30 1 #Up
34 15 14 1
35 15 16 1
|
|---|
