Entry |
|
Name |
Pinoquercetin;
6-C-Methylquercetin
|
Formula |
C16H12O7
|
Exact mass |
316.0583
|
Mol weight |
316.2623
|
Structure |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C10120 Pinoquercetin
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Flavonols
C10120 Pinoquercetin
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 23
1 C8y C 27.0593 -17.2725
2 C8y C 27.0593 -18.6445
3 O2x O 28.2855 -16.5659
4 C8x C 25.8506 -16.5659
5 C8y C 28.2855 -19.3627
6 C8y C 25.8506 -19.3627
7 C8y C 29.4999 -17.2725
8 C8y C 24.6420 -17.2725
9 C8y C 29.4999 -18.6445
10 O5x O 28.2855 -20.7756
11 C8y C 24.6420 -18.6445
12 O1a O 25.8506 -20.7756
13 C8y C 30.6911 -16.5659
14 O1a O 23.3985 -16.5892
15 O1a O 30.7144 -19.3394
16 C1a C 23.4276 -19.3394
17 C8x C 30.6911 -15.1879
18 C8x C 31.9054 -17.2725
19 C8y C 31.9054 -14.4756
20 C8x C 33.1257 -16.5659
21 C8y C 33.1257 -15.1879
22 O1a O 31.9054 -13.0861
23 O1a O 34.3694 -14.5223
BOND 25
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 2
8 5 9 1
9 5 10 2
10 6 11 2
11 6 12 1
12 7 13 1
13 8 14 1
14 9 15 1
15 11 16 1
16 13 17 2
17 13 18 1
18 17 19 1
19 18 20 2
20 19 21 2
21 19 22 1
22 21 23 1
23 7 9 2
24 8 11 1
25 20 21 1
|