Entry |
|
Name |
Isocorypalmine;
5,8,13,13a-Tetrahydrocolumbamine;
(S)-Tetrahydrocolumbamine;
(13aS)-5,8,13,13a-Tetrahydro-3,9,10-trimethoxy-6H-dibenzo[a,g]quinolizin-2-ol
|
Formula |
C20H23NO4
|
Exact mass |
341.1627
|
Mol weight |
341.40
|
Structure |
|
Reaction |
|
Pathway |
map00950 | Isoquinoline alkaloid biosynthesis |
map01063 | Biosynthesis of alkaloids derived from shikimate pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Module |
M00946 | Noscapine biosynthesis, (S)-reticuline => noscapine |
|
Enzyme |
|
Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from tyrosine
Isoquinoline alkaloids
C04118 (S)-Tetrahydrocolumbamine
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 25
1 C1y C 28.8347 -16.2814
2 C8y C 27.5526 -15.6055
3 N1y N 30.0466 -15.5879
4 C1x C 28.8463 -17.6739
5 C8y C 27.6052 -14.2070
6 C8x C 26.4165 -16.3221
7 C1x C 31.2586 -16.2697
8 C1x C 30.0349 -14.1837
9 C8y C 30.0582 -18.3731
10 C8x C 26.3815 -13.5135
11 C1x C 28.8171 -13.4904
12 C8y C 25.1872 -15.6404
13 C8y C 31.2586 -17.6682
14 C8x C 30.0642 -19.7658
15 C8y C 25.1755 -14.2303
16 O1a O 23.8585 -16.0948
17 C8y C 32.4765 -18.3615
18 C8x C 31.2703 -20.4532
19 O2a O 23.8237 -13.8108
20 C8y C 32.4765 -19.7599
21 O2a O 33.6824 -17.6506
22 C1a C 22.5882 -14.7606
23 O2a O 33.6941 -20.4532
24 C1a C 34.9062 -18.3557
25 C1a C 34.9119 -19.7483
BOND 28
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 7 13 1
13 9 14 1
14 10 15 1
15 12 16 1
16 13 17 1
17 14 18 2
18 15 19 1
19 17 20 2
20 17 21 1
21 19 22 1
22 20 23 1
23 21 24 1
24 23 25 1
25 8 11 1
26 9 13 2
27 12 15 2
28 18 20 1
|