| Entry |
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| Name |
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| Formula |
C21H21O11
|
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| Exact mass |
449.1084
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| Mol weight |
449.3848
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| Structure |
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| Reaction |
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| Pathway |
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| Enzyme |
2.4.1.-
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1201 Anthocyanidins
C16298 Cyanidin 5-O-glucoside
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Anthocyanidins and anthocyanins
C16298 Cyanidin 5-O-glucoside
Glycosides [BR:br08021]
O-glycosides
Anthocyanin glycosides
Glycosylated cyanidin
C16298 Cyanidin 5-O-glucoside
Dietary phytochemicals [br08012.html]
Flavonoids
C16298
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 32
1 C8y C 41.3700 -27.2300
2 C8y C 41.3700 -25.8300
3 C8x C 40.1800 -25.1300
4 C8y C 38.9200 -25.8300
5 C8x C 38.9200 -27.2300
6 C8y C 40.1800 -27.9300
7 C8x C 42.4900 -27.9300
8 C8y C 43.7500 -27.2300
9 C8y C 43.7500 -25.8300
10 O2x O 42.4900 -25.1300 #+
11 O2a O 40.1800 -29.3300
12 O1a O 37.7300 -25.1300
13 C8y C 44.9400 -25.1300
14 C8x C 46.1300 -25.8300
15 C8y C 47.3900 -25.1300
16 C8y C 47.3900 -23.7300
17 C8x C 46.2000 -23.0300
18 C8x C 44.9400 -23.7300
19 O1a O 48.5800 -23.0300
20 O1a O 44.9400 -27.9300
21 O1a O 48.5800 -25.8300
22 C1y C 38.9200 -30.0300
23 O2x O 37.7300 -29.3300
24 C1y C 36.5400 -30.0300
25 C1y C 36.5400 -31.4300
26 C1y C 37.7300 -32.1300
27 C1y C 38.9200 -31.4300
28 C1b C 35.3500 -29.3300
29 O1a O 34.1600 -30.0300
30 O1a O 35.2800 -32.0600
31 O1a O 37.7300 -33.5300
32 O1a O 40.1800 -32.1300
BOND 35
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 2 10 1
12 6 11 1
13 4 12 1
14 9 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 13 18 1
21 16 19 1
22 8 20 1
23 15 21 1
24 22 11 1 #Up
25 22 23 1
26 23 24 1
27 24 25 1
28 25 26 1
29 26 27 1
30 22 27 1
31 24 28 1 #Up
32 28 29 1
33 25 30 1 #Down
34 26 31 1 #Up
35 27 32 1 #Down
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