| Entry |
|
|---|
| Name |
(S)-1-Hydroxy-N-methylcanadine
|
|---|
| Formula |
C21H24NO5
|
|---|
| Exact mass |
370.1654
|
|---|
| Mol weight |
370.419
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00950 | Isoquinoline alkaloid biosynthesis |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00946 | Noscapine biosynthesis, (S)-reticuline => noscapine |
|
|---|
| Enzyme |
|
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| Other DBs |
|
|---|
| LinkDB |
|
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| KCF data |
ATOM 27
1 C1y C 18.4715 -15.5217
2 C8y C 17.2073 -14.8194
3 N2y N 19.6655 -14.8194 #+
4 C1x C 18.4715 -16.9264
5 C8y C 17.2073 -13.4147
6 C8y C 16.0133 -15.5217
7 C1x C 20.8594 -15.4515
8 C1x C 19.6655 -13.4147
9 C1a C 20.6487 -13.7659
10 C8y C 19.6655 -17.5585
11 C8x C 16.0133 -12.7124
12 C1x C 18.4013 -12.7124
13 C8y C 14.7492 -14.8896
14 C8y C 20.8594 -16.8561
15 C8x C 19.7357 -18.9631
16 C8y C 14.7492 -13.4850
17 O2x O 13.4850 -15.3110
18 C8y C 22.1236 -17.5585
19 C8x C 20.9297 -19.6655
20 O2x O 13.4147 -13.0636
21 C1x C 12.6422 -14.1873
22 C8y C 22.1236 -18.9631
23 O2a O 23.3176 -16.8561
24 O2a O 23.3176 -19.6655
25 C1a C 24.5115 -17.5585
26 C1a C 24.5818 -18.9631
27 O1a O 16.0133 -16.9217
BOND 31
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 2
11 5 12 1
12 6 13 1
13 7 14 1
14 10 15 1
15 11 16 1
16 13 17 1
17 14 18 1
18 15 19 2
19 16 20 1
20 17 21 1
21 18 22 2
22 18 23 1
23 22 24 1
24 23 25 1
25 24 26 1
26 8 12 1
27 10 14 2
28 13 16 2
29 19 22 1
30 20 21 1
31 6 27 1
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