| Entry |
|
|---|
| Name |
(R,S)-Nicotine;
(+/-)-3-(1-Methyl-2-pyrrolidinyl)pyridine
|
|---|
| Formula |
C10H14N2
|
|---|
| Exact mass |
162.1157
|
|---|
| Mol weight |
162.23
|
|---|
| Structure |
|
|---|
| Module |
| M00811 | Nicotine degradation, pyrrolidine pathway, nicotine => succinate semialdehyde |
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 12
1 C8x C 34.3503 -22.6681
2 C8x C 34.3503 -24.0672
3 N5x N 35.5395 -24.7667
4 C8x C 36.7986 -24.0672
5 C8y C 36.7986 -22.6681
6 C8x C 35.5395 -21.9686
7 C1y C 37.9878 -21.9686
8 N1y N 39.3169 -22.3184
9 C1x C 40.1563 -21.1991
10 C1x C 39.2470 -20.0799
11 C1x C 37.9878 -20.5695
12 C1a C 39.7830 -23.6581
BOND 13
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 7 11 1
12 5 7 1
13 8 12 1
|
|---|
