| Entry |
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| Name |
Quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside;
Baimaside;
Quercetin 3-beta-D-sophoroside;
Quercetin 3-O-sophoroside;
QUOSP
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| Formula |
C27H30O17
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| Exact mass |
626.1483
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| Mol weight |
626.5169
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| Structure |
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| Reaction |
R06812 R06813
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| Pathway |
| map00944 | Flavone and flavonol biosynthesis |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Enzyme |
2.4.1.239 2.4.1.240
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C12667 Quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Flavonols
C12667 Quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside
Glycosides [BR:br08021]
O-glycosides
Flavonoid glycosides
Flavones and flavonols
C12667 Quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside
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| Other DBs |
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| KCF data |
ATOM 44
1 O2x O 27.6156 -18.3271
2 C1y C 27.6156 -19.7275
3 C1y C 28.8313 -20.4277
4 C1y C 30.0398 -19.7275
5 C1y C 30.0398 -18.3271
6 C1y C 28.8313 -17.6270
7 O2a O 28.8332 -16.2266
8 C1b C 26.4033 -20.4284
9 O1a O 31.2531 -20.5668
10 O2a O 31.2531 -17.6278
11 O1a O 28.8332 -21.8280
12 C1y C 32.4654 -18.3290
13 O2x O 32.4588 -19.7273
14 C1y C 33.6711 -20.4284
15 C1y C 34.8842 -19.7292
16 C1y C 34.8853 -18.3288
17 C1y C 33.6731 -17.6276
18 C1b C 33.6699 -21.8287
19 O1a O 32.4568 -22.5281
20 O1a O 36.0965 -20.4302
21 O1a O 36.0986 -17.6295
22 O1a O 33.6719 -16.2273
23 O1a O 26.4040 -21.8287
24 C8y C 27.6333 -14.1254
25 C8y C 27.6275 -15.5242
26 C8y C 28.8449 -13.4290
27 O2x O 26.4217 -13.4172
28 C8y C 26.4099 -16.2208
29 C8x C 28.8508 -12.0300
30 C8x C 30.0507 -14.1371
31 C8y C 25.2043 -14.1137
32 C8y C 25.1985 -15.5125
33 O5x O 26.4042 -17.6197
34 C8x C 30.0624 -11.3335
35 C8y C 31.2681 -13.4407
36 C8x C 23.9986 -13.4113
37 C8y C 23.9986 -16.2149
38 C8y C 31.2740 -12.0417
39 C8y C 22.7811 -14.1137
40 C8x C 22.7811 -15.5125
41 O1a O 23.9986 -17.6139
42 O1a O 32.4914 -11.3452
43 O1a O 21.5695 -13.4113
44 O1a O 32.4780 -14.1459
BOND 48
1 5 6 1
2 12 10 1 #Up
3 6 1 1
4 6 7 1 #Up
5 1 2 1
6 2 8 1 #Up
7 12 13 1
8 13 14 1
9 14 15 1
10 15 16 1
11 16 17 1
12 17 12 1
13 2 3 1
14 14 18 1 #Up
15 4 9 1 #Up
16 18 19 1
17 3 4 1
18 15 20 1 #Down
19 5 10 1 #Down
20 16 21 1 #Up
21 4 5 1
22 17 22 1 #Down
23 3 11 1 #Down
24 8 23 1
25 24 25 2
26 24 26 1
27 24 27 1
28 25 28 1
29 25 7 1
30 26 29 1
31 26 30 2
32 27 31 1
33 28 32 1
34 28 33 2
35 29 34 2
36 30 35 1
37 31 36 2
38 32 37 2
39 34 38 1
40 36 39 1
41 37 40 1
42 37 41 1
43 38 42 1
44 39 43 1
45 31 32 1
46 35 38 2
47 39 40 2
48 35 44 1
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