| Entry |
|
|---|
| Name |
|
|---|
| Formula |
C18H25NO6
|
|---|
| Exact mass |
351.1682
|
|---|
| Mol weight |
351.3942
|
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| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00960 | Tropane, piperidine and pyridine alkaloid biosynthesis |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Enzyme |
|
|---|
| Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from ornithine
Pyrrolizidine alkaloids
C15612 Senecionine N-oxide
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C15612
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| Other DBs |
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| LinkDB |
|
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| KCF data |
ATOM 25
1 C1y C 26.2819 -19.1109
2 C1y C 25.1062 -18.4193
3 N2y N 26.2995 -20.1760 #+
4 C2y C 27.4823 -18.4381
5 C1x C 23.9888 -19.6255
6 O7x O 25.1062 -17.0547
7 C1x C 25.0234 -20.8199
8 C1x C 27.5592 -20.8199
9 C2x C 28.5168 -19.6255
10 C1x C 27.4823 -17.0604
11 C7x C 23.9118 -16.3687
12 O7x O 28.6826 -16.3804
13 C2y C 23.9118 -14.9912
14 O6a O 22.7173 -17.0604
15 C7x C 28.6884 -14.9969
16 C1x C 25.1062 -14.2995
17 C2b C 22.7173 -14.2995
18 C1z C 27.4939 -14.3052
19 O6a O 29.8700 -14.2995
20 C1y C 26.2995 -14.9912
21 C1a C 21.5240 -14.9912
22 C1a C 26.7963 -13.1048
23 O1a O 27.8486 -12.9698
24 C1a C 26.2936 -16.2987
25 O3a O 26.2995 -21.5760 #-
BOND 27
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 1
8 4 9 2
9 4 10 1
10 6 11 1
11 10 12 1
12 11 13 1
13 11 14 2
14 12 15 1
15 13 16 1
16 13 17 2
17 15 18 1
18 15 19 2
19 16 20 1
20 17 21 1
21 18 22 1 #Down
22 18 23 1 #Up
23 20 24 1 #Down
24 5 7 1
25 8 9 1
26 18 20 1
27 3 25 1
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