Entry |
|
Name |
|
Formula |
C25H24O13
|
Exact mass |
532.1217
|
Mol weight |
532.4503
|
Structure |
|
Reaction |
|
Pathway |
|
Enzyme |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1205 Isoflavonoids
C16197 Malonylglycitin
Phytochemical compounds [BR:br08003]
Flavonoids
Isoflavonoids
Isoflavones
C16197 Malonylglycitin
Glycosides [BR:br08021]
O-glycosides
Flavonoid glycosides
Isoflavones
C16197 Malonylglycitin
Dietary phytochemicals [br08012.html]
Flavonoids
C16197
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 38
1 C8y C 34.3000 -34.3000
2 C8y C 34.3000 -35.7000
3 C8x C 35.5600 -36.4000
4 C8y C 36.7500 -35.7000
5 C8y C 36.7500 -34.3000
6 C8x C 35.5600 -33.6000
7 C8y C 37.9400 -36.4000
8 C8y C 39.2000 -35.7000
9 C8x C 39.2000 -34.3000
10 O2x O 37.9400 -33.6000
11 C8y C 40.3900 -36.4000
12 C8x C 40.3900 -37.8000
13 C8x C 41.5800 -38.5000
14 C8y C 42.7700 -37.8000
15 C8x C 42.7700 -36.4000
16 C8x C 41.5800 -35.7000
17 O2a O 33.1100 -36.4000
18 C1a C 33.1100 -37.8000
19 O2a O 33.1100 -33.6000
20 C1y C 31.9200 -34.3000
21 O2x O 30.7300 -33.6000
22 C1y C 29.5400 -34.3000
23 C1y C 29.5400 -35.7000
24 C1y C 30.6600 -36.4000
25 C1y C 31.9200 -35.7000
26 O1a O 31.9200 -37.1000
27 O1a O 30.6600 -37.8000
28 O1a O 28.2800 -36.4700
29 C1b C 28.2800 -33.6000
30 O5x O 37.9400 -37.8000
31 O1a O 44.0300 -38.5000
32 O7a O 27.0900 -34.3000
33 C7a C 25.9000 -33.6000
34 C1b C 24.7100 -34.3000
35 O6a O 25.9000 -32.2000
36 C6a C 23.5200 -33.6000
37 O6a O 22.3300 -34.3000
38 O6a O 23.5200 -32.2000
BOND 41
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 2
10 9 10 1
11 5 10 1
12 8 11 1
13 11 12 2
14 12 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 11 16 1
19 2 17 1
20 17 18 1
21 1 19 1
22 20 19 1 #Up
23 20 21 1
24 21 22 1
25 22 23 1
26 23 24 1
27 24 25 1
28 20 25 1
29 25 26 1 #Down
30 24 27 1 #Up
31 23 28 1 #Down
32 22 29 1 #Up
33 7 30 2
34 14 31 1
35 29 32 1
36 32 33 1
37 33 34 1
38 33 35 2
39 34 36 1
40 36 37 1
41 36 38 2
|