Entry |
|
Name |
Hesperetin;
3',5,7-Trihydroxy-4'-methoxyflavanone
|
Formula |
C16H14O6
|
Exact mass |
302.079
|
Mol weight |
302.2788
|
Structure |
|
Reaction |
|
Pathway |
|
Enzyme |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1214 Flavanones
C01709 Hesperetin
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Flavanones
C01709 Hesperetin
Dietary phytochemicals [br08012.html]
Flavonoids
C01709
|
Other DBs |
|
KCF data |
ATOM 22
1 C8y C 24.0633 -23.0471
2 C8y C 24.0633 -21.6454
3 C5x C 25.2867 -23.7480
4 C8y C 22.8463 -23.7545
5 O2x O 25.2802 -20.9317
6 C8x C 22.8463 -20.9508
7 C1x C 26.5102 -23.0536
8 O5x O 25.2867 -25.2765
9 C8x C 21.6482 -23.0471
10 O1a O 22.8463 -25.2829
11 C1y C 26.5037 -21.6389
12 C8y C 21.6482 -21.6454
13 C8y C 27.7017 -20.9380
14 O1a O 20.4502 -20.9508
15 C8x C 27.6952 -19.5617
16 C8x C 28.9059 -21.6262
17 C8y C 28.8869 -18.8543
18 C8x C 30.1102 -20.9380
19 C8y C 30.0912 -19.5426
20 O1a O 28.9441 -17.6112
21 O2a O 31.2892 -18.8416
22 C1a C 32.5013 -19.5319
BOND 24
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 3 8 2
8 4 9 2
9 4 10 1
10 5 11 1
11 6 12 2
12 11 13 1 #Down
13 12 14 1
14 13 15 2
15 13 16 1
16 15 17 1
17 16 18 2
18 17 19 2
19 17 20 1
20 19 21 1
21 7 11 1
22 9 12 1
23 18 19 1
24 21 22 1
|