| Entry |
|
|---|
| Name |
Chikusetsusaponin V;
Ginsenoside Ro
|
|---|
| Formula |
C48H76O19
|
|---|
| Exact mass |
956.4981
|
|---|
| Mol weight |
957.1056
|
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| Structure |
|
|---|
| Brite |
Phytochemical compounds [BR:br08003]
Terpenoids
Triterpenoids (C30)
Oleananes
C17543 Chikusetsusaponin V
Glycosides [BR:br08021]
O-glycosides
Saponins
Triterpenoid
C17543 Chikusetsusaponin V
|
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| Other DBs |
|
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| LinkDB |
|
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| KCF data |
ATOM 67
1 C1z C 35.2100 -27.4400
2 C1y C 35.2100 -28.9100
3 C1x C 36.4700 -29.6100
4 C1z C 37.7300 -28.9100
5 C1x C 37.7300 -27.4400
6 C1x C 36.4700 -26.7400
7 C1x C 34.0200 -26.7400
8 C1x C 32.7600 -27.4400
9 C1z C 32.7600 -28.9100
10 C2y C 34.0200 -29.6100
11 C1z C 31.5700 -29.6100
12 C1y C 31.5700 -31.0100
13 C1x C 32.7600 -31.7100
14 C2x C 34.0200 -31.0100
15 C1x C 30.3800 -28.9100
16 C1x C 29.1200 -29.6100
17 C1y C 29.1200 -31.0100
18 C1z C 30.3800 -31.7100
19 C1z C 27.9300 -31.7100
20 C1y C 27.9300 -33.1100
21 C1x C 29.1200 -33.8100
22 C1x C 30.3800 -33.1100
23 C7a C 35.2100 -26.0400
24 O7a O 36.4700 -25.3400
25 O6a O 34.0200 -25.3400
26 C1a C 32.7600 -29.9600
27 C1a C 31.5700 -28.2100
28 C1a C 30.3800 -30.4500
29 C1a C 26.7400 -31.0100
30 C1a C 26.7400 -32.4100
31 O2a O 26.7400 -33.8100
32 C1y C 25.4800 -34.5100
33 O2x O 24.2900 -33.7400
34 C1y C 23.0300 -34.4400
35 C1y C 23.0300 -35.8400
36 C1y C 24.2900 -36.5400
37 C1y C 25.4800 -35.9100
38 C6a C 21.8400 -33.7400
39 O6a O 20.6500 -34.4400
40 O6a O 21.8400 -32.3400
41 O1a O 21.8400 -36.5400
42 O1a O 24.2900 -37.9400
43 O2a O 26.6700 -36.6100
44 C1a C 38.9200 -29.6100
45 C1a C 37.7300 -30.3100
46 C1y C 37.5900 -24.5000
47 O2x O 37.5900 -23.1000
48 C1y C 38.7800 -25.2000
49 C1y C 40.0400 -24.5000
50 C1y C 40.0400 -23.1000
51 C1y C 38.7800 -22.4000
52 C1b C 38.7100 -21.0000
53 O1a O 39.9700 -20.3000
54 O1a O 41.2300 -22.4000
55 O1a O 41.2300 -25.2700
56 O1a O 38.7100 -26.6000
57 C1y C 27.9300 -37.2400
58 C1y C 27.9300 -38.6400
59 C1y C 29.1200 -39.3400
60 C1y C 30.3800 -38.6400
61 C1y C 30.3800 -37.2400
62 O2x O 29.1200 -36.5400
63 C1b C 31.5866 -36.5300
64 O1a O 32.7963 -37.2153
65 O1a O 31.5866 -39.3500
66 O1a O 26.7147 -39.3351
67 O1a O 29.1028 -40.7399
BOND 74
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 2 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 2
17 11 15 1
18 15 16 1
19 16 17 1
20 17 18 1
21 12 18 1
22 17 19 1
23 19 20 1
24 20 21 1
25 21 22 1
26 18 22 1
27 1 23 1 #Down
28 23 24 1
29 23 25 2
30 9 26 1 #Up
31 11 27 1 #Down
32 18 28 1 #Down
33 19 29 1
34 19 30 1
35 20 31 1 #Down
36 32 31 1 #Up
37 32 33 1
38 33 34 1
39 34 35 1
40 35 36 1
41 36 37 1
42 32 37 1
43 34 38 1 #Up
44 38 39 2
45 38 40 1
46 35 41 1 #Down
47 36 42 1 #Up
48 37 43 1 #Down
49 4 44 1
50 4 45 1
51 46 24 1 #Down
52 47 46 1
53 46 48 1
54 48 49 1
55 49 50 1
56 50 51 1
57 47 51 1
58 51 52 1 #Down
59 52 53 1
60 50 54 1 #Up
61 49 55 1 #Down
62 48 56 1 #Up
63 57 43 1 #Down
64 57 58 1
65 58 59 1
66 59 60 1
67 60 61 1
68 61 62 1
69 57 62 1
70 61 63 1 #Down
71 63 64 1
72 60 65 1 #Up
73 58 66 1 #Up
74 59 67 1 #Down
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