| Entry |
|
|---|
| Name |
Calystegin A3;
Calystegine A3
|
|---|
| Formula |
C7H13NO3
|
|---|
| Exact mass |
159.0895
|
|---|
| Mol weight |
159.183
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00960 | Tropane, piperidine and pyridine alkaloid biosynthesis |
|
|---|
| Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from ornithine
Tropane alkaloids
C10850 Calystegin A3
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 11
1 O1a O 29.2844 -18.2422
2 C1y C 27.9038 -18.4374
3 C1x C 26.9496 -16.9841
4 C1y C 26.9496 -17.9802
5 C1y C 25.5543 -16.9841
6 C1z C 25.4716 -17.9802
7 N1x N 24.7479 -16.1045
8 C1x C 24.5640 -17.5624
9 C1x C 24.0485 -18.6201
10 O1a O 26.9359 -19.3042
11 O1a O 25.4584 -19.3042
BOND 12
1 2 4 1
2 3 5 1
3 4 6 1
4 5 7 1
5 5 8 1
6 6 9 1
7 6 7 1
8 8 9 1
9 2 1 1 #Up
10 4 10 1 #Down
11 2 3 1
12 6 11 1
|
|---|
