Entry |
|
Name |
Desacetoxyvindoline;
16-Methoxy-2,3-dihydro-3-hydroxy-N-methyltabersonine;
Deacetoxyvindoline
|
Formula |
C23H30N2O4
|
Exact mass |
398.2206
|
Mol weight |
398.4953
|
Structure |
|
Reaction |
|
Pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Module |
M00965 | Vindoline biosynthesis, tabersonine => vindoline |
|
Enzyme |
|
Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from tryptophan and anthranilic acid
Indole alkaloids
C02673 Desacetoxyvindoline
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 29
1 C1z C 26.7908 -14.4762
2 C1y C 27.9378 -13.8061
3 C1y C 26.7908 -15.8045
4 C8y C 24.4905 -14.4823
5 C1x C 25.9334 -13.3835
6 C1z C 29.1033 -14.4703
7 N1y N 27.9258 -12.4597
8 C1z C 27.9499 -16.4747
9 N1y N 25.6436 -16.4747
10 C8y C 24.4905 -15.8045
11 C8x C 23.3371 -13.8242
12 C1x C 26.6096 -12.3812
13 C1x C 29.1491 -15.8286
14 C2x C 30.2685 -13.7941
15 C1b C 30.2261 -15.1223
16 C1x C 29.0912 -11.7835
17 C7a C 28.8678 -17.3985
18 O1a O 27.2375 -18.1351
19 C1a C 24.7681 -18.1834
20 C8x C 23.3371 -16.4807
21 C8x C 22.2022 -14.4823
22 C2x C 30.2685 -12.4476
23 C1a C 31.3674 -14.4641
24 O7a O 28.8737 -18.9803
25 O6a O 30.1417 -17.6883
26 C8y C 22.2022 -15.8045
27 C1a C 27.5033 -19.9223
28 O2a O 21.0611 -16.4565
29 C1a C 19.9260 -15.7985
BOND 33
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 2
10 4 11 1
11 5 12 1
12 6 13 1
13 6 14 1
14 6 15 1 #Down
15 7 16 1
16 8 17 1 #Down
17 8 18 1 #Up
18 9 19 1
19 10 20 1
20 11 21 2
21 14 22 2
22 15 23 1
23 17 24 1
24 17 25 2
25 20 26 2
26 24 27 1
27 26 28 1
28 28 29 1
29 7 12 1
30 8 13 1
31 9 10 1
32 16 22 1
33 21 26 1
|