 | | COMPOUND: C21591 | |
| Entry |
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| Name |
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| Formula |
C24H27NO8
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| Exact mass |
457.1737
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| Mol weight |
457.4731
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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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| KCF data |
ATOM 33
1 C1y C 18.5647 -15.4823
2 C8y C 17.3038 -14.7817
3 N1y N 19.7556 -14.7817
4 C1c C 18.5647 -16.9535
5 C8y C 17.3038 -13.3806
6 C8y C 16.1128 -15.4823
7 C1x C 19.7556 -13.3806
8 C1a C 20.8064 -13.5909
9 C8y C 19.7556 -17.5839
10 C8x C 16.1128 -12.6801
11 C1x C 18.4946 -12.6801
12 C8y C 14.7817 -14.8518
13 C8y C 20.9466 -16.8834
14 C8x C 19.7557 -18.9850
15 C8y C 14.7817 -13.4507
16 O2x O 13.5207 -15.2721
17 C8y C 22.1375 -17.5839
18 C8x C 21.0166 -19.6856
19 O2x O 13.4507 -13.0303
20 C1x C 12.6801 -14.1512
21 C8y C 22.1375 -18.9850
22 O2a O 23.3285 -16.8834
23 O2a O 23.3285 -19.6856
24 C1a C 24.5194 -17.5839
25 C1a C 24.5895 -18.9850
26 O7a O 17.3038 -17.6540
27 C7a C 17.3037 -19.0551
28 C1a C 16.1829 -19.7556
29 O6a O 18.5647 -19.7556
30 C4a C 20.9466 -15.4823
31 O4a O 22.0675 -14.7817
32 O2a O 16.1128 -16.8842
33 C1a C 14.8987 -17.5851
BOND 36
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 4 9 1
9 5 10 2
10 5 11 1
11 6 12 1
12 9 14 1
13 10 15 1
14 12 16 1
15 13 17 1
16 14 18 2
17 15 19 1
18 16 20 1
19 17 21 2
20 17 22 1
21 21 23 1
22 22 24 1
23 23 25 1
24 7 11 1
25 9 13 2
26 12 15 2
27 18 21 1
28 19 20 1
29 26 27 1
30 4 26 1 #Down
31 27 28 1
32 27 29 2
33 13 30 1
34 30 31 2
35 6 32 1
36 32 33 1
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