Entry |
|
Name |
Hyperin;
Quercetin 3-galactoside
|
Formula |
C21H20O12
|
Exact mass |
464.0955
|
Mol weight |
464.37
|
Structure |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C10073 Hyperin
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Flavonols
C10073 Hyperin
Glycosides [BR:br08021]
O-glycosides
Flavonoid glycosides
Flavones and flavonols
C10073 Hyperin
Dietary phytochemicals [br08012.html]
Flavonoids
C10073
|
Other DBs |
|
KCF data |
ATOM 33
1 C8y C 28.7174 -15.4932
2 C8y C 28.7115 -16.8875
3 C8y C 29.9249 -14.7988
4 O2x O 27.5097 -14.7988
5 C8y C 27.5038 -17.5818
6 O2a O 29.9075 -17.5935
7 C8x C 29.9249 -13.4102
8 C8x C 31.1269 -15.4932
9 C8y C 26.3078 -15.4872
10 C8y C 26.3020 -16.8817
11 O5x O 27.4921 -18.9762
12 C1y C 31.3836 -18.4102
13 C8y C 31.1269 -12.7043
14 C8x C 32.3346 -14.7988
15 C8x C 25.1001 -14.7930
16 C8y C 25.1001 -17.5759
17 O2x O 31.3895 -19.7988
18 C1y C 32.5796 -17.7160
19 C8y C 32.3346 -13.4102
20 O1a O 31.1210 -11.3158
21 C8y C 23.8866 -15.4872
22 C8x C 23.8924 -16.8875
23 O1a O 25.1001 -18.9704
24 C1y C 32.5972 -20.4872
25 C1y C 33.7873 -18.3985
26 O1a O 32.5738 -16.3215
27 O1a O 33.5481 -12.7043
28 O1a O 22.6730 -14.7988
29 C1y C 33.7932 -19.7871
30 C1b C 32.6029 -21.8758
31 O1a O 34.9950 -17.7043
32 O1a O 35.0007 -20.4815
33 O1a O 31.4012 -22.5759
BOND 36
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 1
9 5 10 1
10 5 11 2
11 12 6 1 #Up
12 7 13 2
13 8 14 1
14 9 15 1
15 10 16 1
16 12 17 1
17 12 18 1
18 13 19 1
19 13 20 1
20 15 21 2
21 16 22 2
22 16 23 1
23 17 24 1
24 18 25 1
25 18 26 1 #Down
26 19 27 1
27 21 28 1
28 24 29 1
29 24 30 1 #Up
30 25 31 1 #Up
31 29 32 1 #Up
32 30 33 1
33 9 10 2
34 14 19 2
35 21 22 1
36 25 29 1
|