Entry |
|
Name |
Asebogenin;
Phloretin 4'-methyl ether
|
Formula |
C16H16O5
|
Exact mass |
288.0998
|
Mol weight |
288.2952
|
Structure |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1212 Chalcones and dihydrochalcones
C09471 Asebogenin
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Dihydrochalcones
C09471 Asebogenin
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 21
1 C8y C 27.0917 -17.6848
2 C8y C 25.8799 -18.3781
3 C8y C 27.0917 -16.2810
4 C5a C 28.3092 -18.3781
5 C8x C 24.6683 -17.6848
6 O1a O 25.8859 -19.7819
7 C8x C 25.8799 -15.5760
8 O1a O 28.3092 -15.5819
9 C1b C 29.5209 -17.6790
10 O5a O 28.3092 -19.7819
11 C8y C 24.6683 -16.2810
12 O2a O 23.4567 -15.5760
13 C1a C 22.2450 -16.2810
14 C1b C 30.7610 -18.3950
15 C8y C 31.9437 -17.7121
16 C8x C 33.1373 -18.4014
17 C8x C 34.3498 -17.7015
18 C8y C 34.3499 -16.3015
19 C8x C 33.1563 -15.6122
20 C8x C 31.9438 -16.3121
21 O1a O 35.5736 -15.5950
BOND 22
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 4 10 2
10 5 11 1
11 11 12 1
12 12 13 1
13 7 11 2
14 9 14 1
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 15 20 1
22 18 21 1
|