Entry |
|
Name |
Gallocatechin-(4alpha->8)-epigallocatechin
|
Formula |
C30H26O14
|
Exact mass |
610.1323
|
Mol weight |
610.519
|
Structure |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1203 Proanthocyanidins
C10227 Gallocatechin-(4alpha->8)-epigallocatechin
Phytochemical compounds [BR:br08003]
Flavonoids
Complex flavonoids
Proanthocyanidins
C10227 Gallocatechin-(4alpha->8)-epigallocatechin
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 44
1 C1y C 26.2093 -19.8842
2 C8y C 24.9968 -19.1847
3 C1y C 27.4276 -19.1847
4 C8y C 24.9968 -17.7915
5 C8y C 23.7843 -19.8783
6 C1y C 27.4276 -17.7857
7 O1a O 28.6343 -19.8842
8 O2x O 26.2150 -17.0803
9 C8x C 23.7900 -17.0862
10 C8x C 22.5777 -19.1788
11 O1a O 22.5660 -20.5721
12 C8y C 22.5777 -17.7857
13 O1a O 21.3653 -17.0803
14 C8y C 28.5583 -16.2462
15 C8x C 29.7707 -16.9515
16 C8x C 28.5583 -14.8413
17 C8y C 30.9890 -16.2462
18 C8y C 29.7766 -14.1477
19 C8y C 30.9890 -14.8472
20 O1a O 29.7766 -12.7487
21 O1a O 32.2073 -14.1477
22 C8y C 26.2079 -21.2789
23 C8y C 27.4159 -21.9886
24 C8y C 24.9910 -21.9886
25 C8y C 27.4100 -23.3876
26 O2x O 28.6283 -21.2891
27 C8x C 24.9910 -23.3876
28 O1a O 23.7726 -21.3532
29 C1x C 28.6166 -24.0928
30 C8y C 26.2093 -24.0871
31 C1y C 29.8407 -22.0003
32 C1y C 29.8350 -23.3993
33 O1a O 26.2093 -25.4859
34 O1a O 31.0473 -24.1045
35 C8y C 31.0533 -21.3007
36 C8x C 32.2656 -22.0119
37 C8x C 31.0590 -19.9016
38 C8y C 33.4840 -21.3124
39 C8y C 32.2773 -19.2081
40 C8y C 33.4899 -19.9134
41 O1a O 34.6965 -22.0236
42 O1a O 32.2832 -17.8090
43 O1a O 34.7082 -19.2198
44 O1a O 32.2148 -16.8131
BOND 49
1 18 20 1
2 19 21 1
3 18 19 1
4 5 10 2
5 1 22 1 #Down
6 5 11 1
7 9 12 2
8 12 13 1
9 6 8 1
10 10 12 1
11 6 14 1 #Down
12 1 2 1
13 1 3 1
14 2 4 2
15 2 5 1
16 3 6 1
17 22 23 1
18 22 24 2
19 23 25 2
20 23 26 1
21 24 27 1
22 24 28 1
23 25 29 1
24 25 30 1
25 26 31 1
26 29 32 1
27 30 33 1
28 32 34 1 #Down
29 27 30 2
30 31 32 1
31 3 7 1 #Up
32 31 35 1 #Down
33 4 8 1
34 4 9 1
35 14 15 2
36 14 16 1
37 15 17 1
38 16 18 2
39 17 19 2
40 35 36 2
41 35 37 1
42 36 38 1
43 37 39 2
44 38 40 2
45 38 41 1
46 39 42 1
47 40 43 1
48 39 40 1
49 17 44 1
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