Entry |
|
Name |
Divostroside;
Sarmentogenin 3-O-alpha-L-diginoside
|
Formula |
C30H46O8
|
Exact mass |
534.3193
|
Mol weight |
534.6814
|
Structure |
|
Brite |
Phytochemical compounds [BR:br08003]
Terpenoids
Steroids
Cardanolide
C08864 Divostroside
Glycosides [BR:br08021]
O-glycosides
Cardiac glycosides
C08864 Divostroside
|
Other DBs |
|
KCF data |
ATOM 38
1 C1y C 22.1363 -20.1469
2 C1x C 22.0960 -21.5312
3 O2x O 20.9670 -19.4225
4 C1y C 20.8790 -22.1791
5 C1y C 19.7447 -20.0810
6 C1y C 19.7066 -21.4596
7 O2a O 20.8393 -23.5622
8 C1a C 18.5756 -19.3566
9 O1a O 18.4911 -22.1073
10 C1a C 19.6171 -24.2073
11 C1z C 30.5038 -16.7219
12 C1y C 29.3088 -17.4031
13 C1z C 30.5212 -15.3524
14 C1x C 32.8819 -16.7509
15 O1a O 30.4922 -18.0915
16 C1y C 28.1258 -16.7043
17 C1x C 29.3088 -18.7786
18 C1y C 31.7163 -14.6815
19 C1x C 29.3321 -14.6523
20 C1a C 30.5096 -13.9711
21 C1x C 32.8993 -15.3815
22 C1z C 26.9262 -17.3914
23 C1y C 28.1374 -15.3291
24 C1x C 28.1141 -19.4611
25 C2y C 31.7279 -13.3003
26 C1y C 26.9205 -18.7669
27 C1x C 25.7371 -16.6986
28 C1a C 26.9146 -16.0103
29 O1a O 26.9495 -14.6290
30 C2x C 33.1031 -13.3003
31 C1x C 31.3086 -11.9891
32 C1x C 25.7371 -19.4611
33 C1x C 24.5363 -17.3914
34 C7x C 33.5224 -11.9891
35 O7x O 32.4219 -11.1912
36 C1y C 24.5363 -18.7669
37 O6a O 34.8338 -11.5639
38 O2a O 23.3474 -19.4611
BOND 43
1 5 6 1
2 1 2 1
3 1 3 1
4 2 4 1
5 3 5 1
6 4 6 1
7 4 7 1 #Down
8 5 8 1 #Down
9 6 9 1 #Down
10 11 12 1
11 11 13 1
12 11 14 1
13 11 15 1 #Up
14 12 16 1
15 12 17 1
16 13 18 1
17 13 19 1
18 13 20 1 #Up
19 14 21 1
20 16 22 1
21 16 23 1
22 17 24 1
23 18 25 1
24 22 26 1
25 22 27 1
26 22 28 1 #Up
27 23 29 1 #Down
28 25 30 2
29 25 31 1
30 26 32 1
31 27 33 1
32 30 34 1
33 31 35 1
34 32 36 1
35 34 37 2
36 36 38 1 #Up
37 18 21 1
38 19 23 1
39 24 26 1
40 33 36 1
41 34 35 1
42 1 38 1 #Up
43 7 10 1
|