| Entry |
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| Name |
(13S,14R)-1,13-Dihydroxy-N-methylcanadine
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| Formula |
C21H24NO6
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| Exact mass |
386.1604
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| Mol weight |
386.4184
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| Structure |
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| Reaction |
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| Pathway |
| map00950 | Isoquinoline alkaloid biosynthesis |
| map01110 | Biosynthesis of secondary metabolites |
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| Module |
| M00946 | Noscapine biosynthesis, (S)-reticuline => noscapine |
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| Enzyme |
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 28
1 C1y C 18.4696 -15.5201
2 C8y C 17.2055 -14.8178
3 N2y N 19.6634 -14.8178 #+
4 C1y C 18.4696 -16.9246
5 C8y C 17.2055 -13.4133
6 C8y C 16.0117 -15.5201
7 C1x C 20.8572 -15.4499
8 C1x C 19.6634 -13.4133
9 C1a C 20.6466 -13.7645
10 C8y C 19.6634 -17.5566
11 C8x C 16.0117 -12.7111
12 C1x C 18.3993 -12.7111
13 C8y C 14.7476 -14.8881
14 C8y C 20.8572 -16.8544
15 C8x C 19.7336 -18.9612
16 C8y C 14.7476 -13.4836
17 O2x O 13.4836 -15.3094
18 C8y C 22.1213 -17.5566
19 C8x C 20.9275 -19.6634
20 O2x O 13.4133 -13.0622
21 C1x C 12.6408 -14.1858
22 C8y C 22.1213 -18.9612
23 O2a O 23.3151 -16.8544
24 O2a O 23.3151 -19.6634
25 C1a C 24.5090 -17.5566
26 C1a C 24.5792 -18.9612
27 O1a O 16.0117 -16.9246
28 O1a O 17.2572 -17.6246
BOND 32
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
32 4 28 1 #Down
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