| Entry |
|
|---|
| Name |
Raucaffricine;
Vomilenine beta-D-glucoside
|
|---|
| Formula |
C27H32N2O8
|
|---|
| Exact mass |
512.2159
|
|---|
| Mol weight |
512.55
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Enzyme |
|
|---|
| Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from tryptophan and anthranilic acid
Indole alkaloids
C02074 Raucaffricine
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C02074
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 37
1 C8x C 11.3400 -15.4000
2 C8x C 11.3400 -16.8000
3 C8x C 12.5524 -17.5000
4 C8y C 13.7649 -16.8000
5 C8y C 13.7649 -15.4000
6 C8x C 12.5524 -14.7000
7 N2x N 14.9773 -17.5000
8 C2y C 16.1897 -16.8000
9 C1z C 16.1897 -15.4000
10 C1y C 17.4022 -17.5000
11 N1y N 18.6146 -16.8000
12 C1y C 18.6146 -15.4000
13 C1x C 17.4022 -14.7000
14 C1x C 17.4022 -18.9000
15 C1y C 18.9646 -18.2000
16 C2y C 19.8270 -18.9000
17 C1y C 19.8270 -17.5000
18 C2b C 21.0395 -19.6000
19 C1a C 21.0395 -21.0000
20 C1y C 19.8270 -14.7000
21 C1y C 17.2971 -13.7101
22 O7a O 17.2971 -12.3101
23 C7a C 16.0847 -11.6101
24 O6a O 14.8722 -12.3101
25 C1a C 16.0847 -10.2101
26 O2a O 21.0394 -16.8000
27 C1y C 22.2518 -17.5000
28 O2x O 22.2518 -18.9000
29 C1y C 23.4643 -19.6000
30 C1y C 24.6767 -18.9000
31 C1y C 24.6767 -17.5000
32 C1y C 23.4643 -16.8000
33 C1b C 23.4643 -21.0000
34 O1a O 25.8891 -16.8000
35 O1a O 23.4643 -15.4000
36 O1a O 25.8891 -19.6000
37 O1a O 24.6767 -21.7000
BOND 43
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 2
9 8 9 1
10 9 5 1 #Down
11 8 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 9 13 1
16 10 14 1
17 14 15 1
18 15 16 1
19 16 17 1
20 11 17 1
21 16 18 2
22 18 19 1
23 12 20 1 #Up
24 15 20 1 #Up
25 20 21 1
26 9 21 1
27 21 22 1 #Down
28 22 23 1
29 23 24 2
30 23 25 1
31 17 26 1 #Down
32 27 26 1 #Up
33 27 28 1
34 28 29 1
35 29 30 1
36 30 31 1
37 31 32 1
38 27 32 1
39 29 33 1 #Up
40 31 34 1 #Up
41 32 35 1 #Down
42 30 36 1 #Down
43 33 37 1
|
|---|
