Entry |
|
Name |
7-Dehydrologanin tetraacetate
|
Formula |
C25H32O14
|
Exact mass |
556.1792
|
Mol weight |
556.5132
|
Structure |
|
Brite |
Lipids [BR:br08002]
PR Prenol lipids
PR01 Isoprenoids
PR0102 C10 isoprenoids (monoterpenes)
PR010207 Iridoid, 10-alkyliridoid and secoiridoid monoterpenoids
C11668 7-Dehydrologanin tetraacetate
Glycosides [BR:br08021]
O-glycosides
Iridoid glycosides
C11668 7-Dehydrologanin tetraacetate
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Other DBs |
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LinkDB |
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KCF data |
ATOM 39
1 C7a C 24.0971 -18.2755
2 O7a O 25.3296 -18.9875
3 O6a O 24.0971 -16.8588
4 C1a C 22.8677 -18.9880
5 O2a O 31.3892 -18.1452
6 C1y C 30.1636 -19.0348
7 O2x O 28.9587 -18.3152
8 C1y C 30.1557 -20.4377
9 C1y C 27.7481 -19.0279
10 C1y C 28.9432 -21.1210
11 O7a O 31.3919 -21.1381
12 C1y C 27.7404 -20.4309
13 C1b C 26.5384 -18.3091
14 O7a O 28.9404 -22.5267
15 O7a O 26.5228 -21.1151
16 C7a C 32.6245 -21.8403
17 O6a O 32.6266 -23.2536
18 C1a C 33.8430 -21.1278
19 C7a C 28.9445 -23.9348
20 O6a O 27.7298 -24.6372
21 C1a C 30.1553 -24.6438
22 C7a C 25.2956 -21.8247
23 O6a O 24.0816 -21.1026
24 C1a C 25.2858 -23.2225
25 C1y C 31.3770 -16.6262
26 C1y C 30.1890 -15.9237
27 C1y C 30.1890 -14.5417
28 C1y C 28.8724 -16.3484
29 C2y C 31.3770 -13.8625
30 C1x C 28.8784 -14.1286
31 O2x O 32.5758 -15.9237
32 C5x C 28.0821 -15.2269
33 C1a C 27.7707 -17.2962
34 C2x C 32.5758 -14.5417
35 C7a C 31.3712 -12.4921
36 O7a O 32.5582 -11.8197
37 O6a O 30.1773 -11.8257
38 C1a C 33.7396 -12.4921
39 O5x O 26.6868 -15.2176
BOND 41
1 8 11 1 #Down
2 19 21 1
3 9 12 1
4 9 13 1 #Up
5 22 15 1
6 22 23 2
7 10 14 1 #Up
8 22 24 1
9 12 15 1 #Down
10 25 5 1 #Up
11 10 12 1
12 13 2 1
13 6 5 1 #Up
14 6 7 1
15 6 8 1
16 7 9 1
17 1 4 1
18 1 2 1
19 16 11 1
20 16 17 2
21 1 3 2
22 16 18 1
23 8 10 1
24 19 14 1
25 26 27 1
26 26 25 1
27 26 28 1
28 27 29 1
29 27 30 1
30 25 31 1
31 28 32 1
32 28 33 1 #Up
33 29 34 2
34 29 35 1
35 35 36 1
36 35 37 2
37 36 38 1
38 30 32 1
39 31 34 1
40 19 20 2
41 32 39 2
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