Entry |
|
Name |
Gambiriin C;
Epiafzelechin-(4beta->8)-catechin
|
Formula |
C30H26O11
|
Exact mass |
562.1475
|
Mol weight |
562.5208
|
Structure |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1203 Proanthocyanidins
C10228 Gambiriin C
Phytochemical compounds [BR:br08003]
Flavonoids
Complex flavonoids
Proanthocyanidins
C10228 Gambiriin C
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 41
1 C1y C 23.5168 -16.8031
2 C8y C 22.3076 -16.1022
3 C1y C 24.8136 -16.1139
4 C8y C 22.3136 -14.7004
5 C8y C 21.0985 -16.8031
6 C1y C 24.7493 -14.7062
7 O1a O 25.9468 -16.8265
8 O2x O 23.5344 -14.0052
9 C8x C 21.1044 -13.9995
10 C8x C 19.8836 -16.1022
11 C8y C 19.8836 -14.7004
12 O1a O 18.6627 -13.9995
13 C8y C 25.9585 -14.0169
14 C8x C 27.1734 -14.7236
15 C8x C 25.9642 -12.6150
16 C8x C 28.3942 -14.0286
17 C8x C 27.1851 -11.9140
18 C8y C 28.4001 -12.6267
19 O1a O 29.6210 -11.9257
20 C8y C 23.5168 -18.1993
21 C8y C 24.7202 -18.9003
22 C8y C 22.3076 -18.8886
23 C8y C 24.7085 -20.2905
24 O2x O 25.9234 -18.2167
25 C8x C 22.3019 -20.2788
26 C1x C 25.9000 -20.9972
27 C8y C 23.5051 -20.9855
28 C1y C 27.1209 -18.9177
29 C1y C 27.1092 -20.3079
30 O1a O 23.5051 -22.3874
31 O1a O 28.3242 -21.0206
32 C8y C 28.3363 -18.2278
33 C8x C 29.5566 -18.9353
34 C8x C 28.3534 -16.8265
35 C8y C 30.7774 -18.2460
36 C8x C 29.5800 -16.1255
37 C8y C 30.7891 -16.8441
38 O1a O 31.9925 -18.9587
39 O1a O 32.0100 -16.1489
40 O1a O 21.0307 -18.3940
41 O1a O 19.8839 -17.4894
BOND 46
1 17 18 1
2 4 8 1
3 1 20 1 #Up
4 4 9 1
5 5 10 2
6 9 11 2
7 11 12 1
8 6 8 1
9 10 11 1
10 6 13 1 #Down
11 1 2 1
12 1 3 1
13 2 4 2
14 20 21 1
15 20 22 2
16 21 23 2
17 21 24 1
18 22 25 1
19 23 26 1
20 23 27 1
21 24 28 1
22 26 29 1
23 27 30 1
24 29 31 1 #Up
25 25 27 2
26 28 29 1
27 2 5 1
28 28 32 1 #Down
29 3 6 1
30 3 7 1 #Down
31 13 14 2
32 13 15 1
33 14 16 1
34 15 17 2
35 16 18 2
36 32 33 2
37 32 34 1
38 33 35 1
39 34 36 2
40 35 37 2
41 35 38 1
42 37 39 1
43 36 37 1
44 22 40 1
45 18 19 1
46 5 41 1
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