| Entry |
|
|---|
| Name |
(-)-Medicocarpin;
Medicarpin 3-O-glucoside
|
|---|
| Formula |
C22H24O9
|
|---|
| Exact mass |
432.142
|
|---|
| Mol weight |
432.4206
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1207 Pterocarpans
C16223 (-)-Medicocarpin
Phytochemical compounds [BR:br08003]
Flavonoids
Isoflavonoids
Pterocarpans
C16223 (-)-Medicocarpin
|
|---|
| Other DBs |
|
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| LinkDB |
|
|---|
| KCF data |
ATOM 31
1 C8y C 17.4300 -20.6500
2 C8x C 17.4300 -22.0500
3 C8x C 18.6200 -22.7500
4 C8y C 19.8800 -22.0500
5 C8y C 19.8800 -20.6500
6 C8x C 18.6200 -19.9500
7 C1y C 21.0700 -22.7500
8 C1y C 22.2600 -22.0500
9 C1x C 22.2600 -20.6500
10 O2x O 21.0700 -19.9500
11 O2x O 21.3500 -24.1500
12 C8y C 22.7500 -24.2900
13 C8y C 23.3100 -22.9600
14 C8x C 23.5900 -25.4100
15 C8y C 24.9900 -25.2700
16 C8x C 25.5500 -23.9400
17 C8x C 24.7100 -22.8200
18 O2a O 25.8300 -26.3900
19 C1a C 27.2300 -26.2500
20 O2a O 16.2400 -19.9500
21 C1y C 12.6000 -20.6500
22 C1y C 12.6000 -22.0500
23 C1y C 13.7900 -22.7500
24 C1y C 15.0500 -22.0500
25 C1y C 15.0500 -20.6500
26 O2x O 13.7900 -19.9500
27 C1b C 11.3847 -19.9549
28 O1a O 13.7728 -24.1499
29 O1a O 11.3847 -22.7451
30 O1a O 16.2566 -22.7600
31 O1a O 10.1963 -20.6477
BOND 35
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 7 11 1
13 11 12 1
14 12 13 1
15 8 13 1
16 12 14 2
17 14 15 1
18 15 16 2
19 16 17 1
20 13 17 2
21 15 18 1
22 18 19 1
23 1 20 1
24 21 22 1
25 22 23 1
26 23 24 1
27 24 25 1
28 25 26 1
29 21 26 1
30 25 20 1 #Up
31 21 27 1 #Up
32 23 28 1 #Up
33 22 29 1 #Down
34 24 30 1 #Down
35 27 31 1
|
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