Entry |
|
Name |
4,21-Dehydrogeissoschizine
|
Formula |
C21H23N2O3
|
Exact mass |
351.1709
|
Mol weight |
351.4189
|
Structure |
|
Reaction |
|
Pathway |
map01063 | Biosynthesis of alkaloids derived from shikimate pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Enzyme |
|
Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from tryptophan and anthranilic acid
Indole alkaloids
C03677 4,21-Dehydrogeissoschizine
|
Other DBs |
|
KCF data |
ATOM 26
1 C1y C 30.0242 -15.2100
2 C1x C 31.2204 -13.1464
3 C1x C 30.0359 -12.4549
4 C8y C 28.8325 -14.5090
5 C8y C 28.8444 -13.0647
6 N4x N 27.6441 -15.2001
7 C8y C 26.4538 -14.4885
8 C8y C 26.4724 -13.1183
9 C8x C 25.2985 -12.4241
10 C8x C 24.1062 -13.0862
11 C8x C 24.0878 -14.4564
12 C8x C 25.2615 -15.1648
13 C1x C 30.0171 -16.6119
14 C1y C 31.2285 -17.3154
15 C2c C 31.2216 -18.7173
16 C2y C 32.4472 -16.6241
17 C2b C 33.6515 -17.3276
18 C7a C 30.0031 -19.4157
19 C2b C 32.4330 -19.4279
20 O1a O 32.4261 -20.8299
21 O7a O 29.9960 -20.8175
22 O6a O 28.7915 -18.7051
23 C2x C 32.4541 -15.2221
24 C1a C 33.6446 -18.7294
25 N2y N 31.2427 -14.5117 #+
26 C1a C 28.7774 -21.5089
BOND 29
1 11 12 2
2 12 7 1
3 1 13 1
4 4 5 2
5 13 14 1
6 1 25 1
7 14 15 1
8 25 2 1
9 14 16 1
10 7 6 1
11 16 17 2
12 6 4 1
13 15 18 1
14 5 8 1
15 15 19 2
16 5 3 1
17 19 20 1
18 2 3 1
19 18 21 1
20 18 22 2
21 1 4 1
22 16 23 1
23 7 8 2
24 8 9 1
25 17 24 1
26 9 10 2
27 23 25 2
28 10 11 1
29 21 26 1
|