Entry |
|
Name |
Cerberin;
2'-Acetylneriifolin
|
Formula |
C32H48O9
|
Exact mass |
576.3298
|
Mol weight |
576.7181
|
Structure |
|
Brite |
Phytochemical compounds [BR:br08003]
Terpenoids
Steroids
Cardanolide
C19984 Cerberin
Natural toxins [BR:br08009]
Phytotoxins
Alkaloids
Others
C19984 Cerberin
Glycosides [BR:br08021]
O-glycosides
Cardiac glycosides
C19984 Cerberin
|
Other DBs |
|
KCF data |
ATOM 41
1 C1y C 22.8200 -20.5800
2 C1y C 22.8200 -21.9800
3 O2x O 21.6300 -19.8800
4 C1y C 21.6300 -22.6800
5 O7a O 24.0800 -22.6100
6 C1y C 20.4400 -20.5800
7 C1y C 20.4400 -21.9800
8 O2a O 21.6300 -24.0800
9 C1a C 19.1800 -19.9500
10 O1a O 19.2500 -22.6800
11 C1a C 20.4400 -24.7800
12 C1y C 28.9800 -17.4300
13 C1x C 28.9800 -16.1000
14 C1z C 27.7200 -18.1300
15 C1y C 30.1700 -18.1300
16 C1x C 30.1700 -15.4000
17 C1y C 27.7200 -19.5300
18 C1x C 26.6000 -17.4300
19 C1a C 27.7900 -16.7300
20 C1z C 31.3600 -17.5000
21 C1x C 30.1700 -19.5300
22 C1z C 31.3600 -16.1000
23 C1x C 26.6000 -20.2300
24 C1x C 28.9800 -20.2300
25 C1x C 25.4100 -18.1300
26 C1x C 33.7400 -17.5000
27 O1a O 31.3600 -18.8300
28 C1y C 32.6200 -15.4000
29 C1a C 31.3600 -14.7000
30 C1y C 25.4100 -19.5300
31 C1x C 33.7400 -16.1000
32 C2y C 32.6200 -14.0000
33 O2a O 24.1500 -20.2300
34 C2x C 33.9500 -14.0000
35 C1x C 32.2000 -12.7400
36 C7x C 34.3700 -12.7400
37 O7x O 33.2500 -11.9000
38 O6a O 35.7000 -12.3200
39 C7a C 25.2700 -21.9100
40 C1a C 26.4600 -22.6100
41 O6a O 25.2700 -20.6500
BOND 46
1 6 7 1
2 1 2 1
3 1 3 1
4 2 4 1
5 2 5 1 #Up
6 3 6 1
7 4 7 1
8 4 8 1 #Down
9 6 9 1 #Down
10 7 10 1 #Up
11 12 13 1
12 12 14 1
13 12 15 1
14 13 16 1
15 14 17 1
16 14 18 1
17 14 19 1 #Up
18 15 20 1
19 15 21 1
20 16 22 1
21 17 23 1
22 17 24 1
23 18 25 1
24 20 26 1
25 20 27 1 #Up
26 22 28 1
27 22 29 1 #Up
28 23 30 1
29 26 31 1
30 28 32 1
31 30 33 1 #Up
32 32 34 2
33 32 35 1
34 34 36 1
35 35 37 1
36 36 38 2
37 20 22 1
38 21 24 1
39 25 30 1
40 28 31 1
41 36 37 1
42 8 11 1
43 1 33 1 #Up
44 5 39 1
45 39 40 1
46 39 41 2
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