| Entry |
|
|---|
| Name |
Festuclavine;
6,8-beta-Dimethylergoline
|
|---|
| Formula |
C16H20N2
|
|---|
| Exact mass |
240.1626
|
|---|
| Mol weight |
240.34
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00964 | Fumigaclavine biosynthesis, chanoclavine-I aldehyde => fumigaclavine C |
|
|---|
| Enzyme |
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 18
1 C8y C 18.6487 -18.9185
2 C8x C 18.6528 -20.2814
3 N4x N 16.3097 -20.2886
4 C8y C 16.3055 -18.9256
5 C8y C 17.4822 -18.2368
6 C1y C 19.8157 -16.8790
7 N1y N 20.9873 -16.1941
8 C1a C 22.1597 -16.8651
9 C1y C 18.6369 -16.2062
10 C1x C 18.6333 -14.8518
11 C1y C 19.8058 -14.1736
12 C1a C 19.8058 -12.8245
13 C1x C 20.9783 -14.8447
14 C8x C 15.1196 -18.2455
15 C8x C 15.1196 -16.8894
16 C8x C 16.2984 -16.2113
17 C8y C 17.5340 -16.8894
18 C1x C 19.8216 -18.2351
BOND 21
1 2 3 1
2 10 11 1
3 1 2 2
4 11 12 1 #Up
5 11 13 1
6 6 7 1
7 3 4 1
8 7 8 1
9 14 15 2
10 15 16 1
11 16 17 2
12 4 14 1
13 4 5 2
14 5 1 1
15 5 17 1
16 17 9 1
17 9 6 1
18 6 18 1
19 18 1 1
20 9 10 1
21 7 13 1
|
|---|
