| Entry |
|
|---|
| Name |
Glycyphyllin;
Phloretin 2'-O-rhamnoside
|
|---|
| Formula |
C21H24O9
|
|---|
| Exact mass |
420.142
|
|---|
| Mol weight |
420.4099
|
|---|
| Structure |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1212 Chalcones and dihydrochalcones
C09754 Glycyphyllin
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Dihydrochalcones
C09754 Glycyphyllin
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 30
1 C8y C 27.7997 -15.5702
2 C8y C 26.5890 -16.2604
3 C5a C 29.0103 -16.2604
4 C8y C 27.7997 -14.1665
5 O2a O 26.5947 -17.6464
6 C8x C 25.3783 -15.5702
7 C1b C 30.2151 -15.5702
8 O5a O 29.0103 -17.6524
9 C8x C 26.5890 -13.4647
10 O1a O 29.0103 -13.4647
11 C1y C 25.1970 -18.4653
12 C8y C 25.3783 -14.1665
13 C1y C 25.1970 -19.8573
14 O2x O 23.9980 -17.7635
15 O1a O 24.1734 -13.4706
16 C1y C 23.9980 -20.5532
17 O1a O 26.4017 -20.5475
18 C1y C 22.7873 -18.4653
19 C1y C 22.7873 -19.8573
20 O1a O 23.9980 -21.9452
21 C1a C 21.5883 -17.7635
22 O1a O 21.5883 -20.5532
23 C1b C 31.4301 -16.2774
24 C8y C 32.6307 -15.5901
25 C8x C 33.8410 -16.2949
26 C8x C 35.0561 -15.5994
27 C8y C 35.0613 -14.1994
28 C8x C 33.8510 -13.4947
29 C8x C 32.6360 -14.1901
30 O1a O 36.2783 -13.5028
BOND 32
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 2
8 4 9 1
9 4 10 1
10 11 5 1 #Up
11 6 12 1
12 11 13 1
13 11 14 1
14 12 15 1
15 13 16 1
16 13 17 1 #Down
17 14 18 1
18 16 19 1
19 16 20 1 #Down
20 18 21 1 #Down
21 19 22 1 #Up
22 9 12 2
23 18 19 1
24 7 23 1
25 23 24 1
26 24 25 2
27 25 26 1
28 26 27 2
29 27 28 1
30 28 29 2
31 24 29 1
32 27 30 1
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|---|
