| Entry |
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| Name |
Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside;
Cyanidin 3-rutinoside 5-glucoside
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| Formula |
C33H41O20
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| Exact mass |
757.2191
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| Mol weight |
757.6666
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| Structure |
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| Comment |
Cyanidin 3-rutinoside 5-glucoside chloride [CPD:C04787]
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| Reaction |
R06819
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| Pathway |
| map00942 | Anthocyanin biosynthesis |
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| Enzyme |
2.4.1.116
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1201 Anthocyanidins
C12646 Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Anthocyanidins and anthocyanins
C12646 Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside
Glycosides [BR:br08021]
O-glycosides
Anthocyanin glycosides
Glycosylated cyanidin
C12646 Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside
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| Other DBs |
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| KCF data |
ATOM 53
1 C8y C 30.4984 -14.1360
2 C8y C 30.4924 -15.5284
3 C8y C 31.7094 -13.4514
4 O2x O 29.3048 -13.4279 #+
5 C8x C 29.2931 -16.2128
6 O2a O 31.8557 -16.3065
7 C8x C 32.8971 -14.1534
8 C8x C 31.7094 -12.0706
9 C8y C 28.0937 -14.1242
10 C8y C 28.0879 -15.5225
11 C1y C 33.1954 -17.2074
12 C8y C 34.0964 -13.4690
13 C8x C 32.9146 -11.3862
14 C8x C 26.8886 -13.4222
15 C8y C 26.8886 -16.2070
16 O2x O 33.1487 -18.5941
17 C1y C 34.4241 -16.5581
18 C8y C 34.1081 -12.0883
19 C8y C 25.6835 -14.1242
20 C8x C 25.6835 -15.5225
21 O2a O 26.8886 -17.6053
22 C1y C 34.3246 -19.3311
23 C1y C 35.6000 -17.2951
24 O1a O 34.4767 -15.1774
25 O1a O 35.3133 -11.3979
26 O1a O 24.4782 -13.4222
27 C1b C 34.2719 -20.7118
28 C1y C 35.6174 -18.6818
29 O1a O 36.8228 -16.6458
30 O2a O 33.1136 -21.3553
31 O1a O 36.7174 -19.4247
32 C1y C 31.7969 -20.5013
33 C1y C 30.5041 -21.1448
34 O2x O 31.7797 -19.1148
35 C1y C 29.4099 -20.4076
36 O1a O 30.4573 -22.5255
37 C1y C 30.6037 -18.3776
38 C1y C 29.3867 -19.0328
39 O1a O 28.1814 -21.2028
40 C1a C 30.6563 -16.9909
41 O1a O 28.2050 -18.3656
42 C1y C 25.6765 -18.3051
43 O2x O 24.4707 -17.6042
44 C1y C 23.2584 -18.3041
45 C1y C 23.2584 -19.7038
46 C1y C 24.4707 -20.4037
47 C1y C 25.6830 -19.7038
48 O1a O 26.8967 -20.2608
49 O1a O 24.4707 -21.8034
50 O1a O 22.0462 -20.4037
51 C1b C 22.0462 -17.6042
52 O1a O 20.8341 -18.3041
53 O1a O 35.3039 -14.1770
BOND 58
1 8 13 2
2 9 14 1
3 10 15 1
4 11 16 1
5 11 17 1
6 12 18 2
7 14 19 2
8 15 20 2
9 15 21 1
10 16 22 1
11 17 23 1
12 17 24 1 #Down
13 18 25 1
14 19 26 1
15 22 27 1 #Up
16 22 28 1
17 23 29 1 #Up
18 27 30 1
19 28 31 1 #Down
20 32 30 1 #Up
21 32 33 1
22 32 34 1
23 33 35 1
24 33 36 1 #Down
25 34 37 1
26 35 38 1
27 35 39 1 #Down
28 37 40 1 #Down
29 38 41 1 #Up
30 9 10 2
31 13 18 1
32 19 20 1
33 23 28 1
34 37 38 1
35 42 21 1 #Up
36 1 2 1
37 1 3 1
38 1 4 2
39 2 5 2
40 2 6 1
41 42 43 1
42 43 44 1
43 44 45 1
44 45 46 1
45 46 47 1
46 47 42 1
47 3 7 2
48 47 48 1 #Down
49 3 8 1
50 46 49 1 #Up
51 4 9 1
52 45 50 1 #Down
53 5 10 1
54 44 51 1 #Up
55 11 6 1 #Up
56 51 52 1
57 7 12 1
58 12 53 1
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