| Entry |
|
|---|
| Name |
Physcion 8-glucoside;
Physcion 8-O-beta-D-monoglucoside
|
|---|
| Formula |
C22H22O10
|
|---|
| Exact mass |
446.1213
|
|---|
| Mol weight |
446.4041
|
|---|
| Structure |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1304 Anthracenes and phenanthrenes
C10384 Physcion 8-glucoside
Phytochemical compounds [BR:br08003]
Polyketides
Anthraquinones
Anthraquinone type
C10384 Physcion 8-glucoside
Glycosides [BR:br08021]
O-glycosides
Anthraquinone glycosides
C10384 Physcion 8-glucoside
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 32
1 C8y C 27.4559 -21.2555
2 C8y C 27.4501 -22.6592
3 C8y C 26.2447 -20.5627
4 C5x C 28.6730 -20.5684
5 C5x C 28.6613 -23.3697
6 C8x C 26.2447 -23.3638
7 O2a O 26.2447 -19.1592
8 C8x C 25.0275 -21.2555
9 C8y C 29.8844 -21.2672
10 O5x O 28.6789 -19.1650
11 C8y C 29.8668 -22.6649
12 O5x O 28.6556 -24.7671
13 C8y C 25.0275 -22.6592
14 C1y C 25.0275 -18.4488
15 C8y C 31.1013 -20.5860
16 C8x C 31.0723 -23.3754
17 O2x O 25.0916 -17.0511
18 C1y C 23.8162 -19.1592
19 C8x C 32.2951 -21.2905
20 O1a O 31.1130 -19.1824
21 C8y C 32.2835 -22.6882
22 C1y C 23.8047 -16.3580
23 C1y C 22.5991 -18.4605
24 O1a O 23.8279 -20.5627
25 O2a O 33.4890 -23.3986
26 C1y C 22.5933 -17.0627
27 C1b C 23.7988 -14.9604
28 O1a O 21.3994 -19.1707
29 O1a O 21.3820 -16.3696
30 O1a O 22.5892 -14.2689
31 C1a C 34.7420 -22.6905
32 C1a C 23.8283 -23.3509
BOND 35
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 1
9 4 10 2
10 5 11 1
11 5 12 2
12 6 13 2
13 14 7 1 #Up
14 9 15 1
15 11 16 1
16 14 17 1
17 14 18 1
18 15 19 2
19 15 20 1
20 16 21 2
21 17 22 1
22 18 23 1
23 18 24 1 #Down
24 21 25 1
25 22 26 1
26 22 27 1 #Up
27 23 28 1 #Up
28 26 29 1 #Down
29 8 13 1
30 9 11 2
31 19 21 1
32 23 26 1
33 27 30 1
34 25 31 1
35 13 32 1
|
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