| Entry |
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| Name |
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| Formula |
C21H25NO5
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| Exact mass |
371.1733
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| Mol weight |
371.43
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| Structure |
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| Remark |
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| Reaction |
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| Pathway |
| map00950 | Isoquinoline alkaloid biosynthesis |
| map01063 | Biosynthesis of alkaloids derived from shikimate pathway |
| map01110 | Biosynthesis of secondary metabolites |
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| Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from tyrosine
Isoquinoline alkaloids
C11250 Demecolcine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L01 ANTINEOPLASTIC AGENTS
L01C PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
L01CC Colchicine derivatives
L01CC01 Demecolcine
C11250 Demecolcine
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 27
1 C8y C 18.2269 -14.9203
2 C2y C 19.3530 -15.7540
3 C8y C 17.0497 -15.6551
4 C8y C 18.1977 -13.5323
5 C2y C 20.7004 -15.4047
6 C2x C 18.7870 -17.0315
7 C8y C 15.8245 -14.9960
8 O2a O 17.0963 -17.0431
9 C8x C 16.9682 -12.8673
10 C1x C 19.2598 -12.6285
11 C1y C 21.2663 -14.1332
12 C2x C 21.8204 -16.2443
13 C2x C 19.4346 -18.2740
14 C8y C 15.8538 -13.6022
15 O2a O 14.6403 -15.7307
16 C1a C 15.9119 -17.7779
17 C1x C 20.6305 -12.8965
18 C5x C 21.8729 -17.6382
19 C2y C 20.8050 -18.5361
20 O2a O 14.5589 -12.9429
21 C1a C 13.4164 -15.0716
22 O5x O 23.1432 -18.1984
23 O2a O 21.1614 -19.8833
24 C1a C 14.4423 -11.5491
25 C1a C 19.9592 -20.8637
26 N1b N 22.6792 -14.1634
27 C1a C 23.6829 -15.4789
BOND 29
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 1
11 5 12 2
12 6 13 1
13 7 14 1
14 7 15 1
15 8 16 1
16 10 17 1
17 12 18 1
18 13 19 2
19 14 20 1
20 15 21 1
21 18 22 2
22 19 23 1
23 20 24 1
24 23 25 1
25 9 14 2
26 11 17 1
27 18 19 1
28 11 26 1
29 26 27 1
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