| Entry |
|
|---|
| Name |
Quercetin 3,4',7-trissulfate
|
|---|
| Formula |
C15H10O16S3
|
|---|
| Exact mass |
541.9131
|
|---|
| Mol weight |
542.43
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00944 | Flavone and flavonol biosynthesis |
|
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| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C03898 Quercetin 3,4',7-trissulfate
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Flavonols
C03898 Quercetin 3,4',7-trissulfate
|
|---|
| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 34
1 C8y C 29.5032 -17.3040
2 C8y C 29.4840 -18.7600
3 C8y C 30.7091 -16.5983
4 O2x O 28.2716 -16.5919
5 C8y C 28.2781 -19.4270
6 O2a O 30.7220 -19.4270
7 C8x C 30.7026 -15.2128
8 C8x C 31.9214 -17.2912
9 C8y C 27.0465 -17.3103
10 C8y C 27.0465 -18.7215
11 O5x O 28.2781 -20.8255
12 S4a S 32.1139 -19.4207
13 C8y C 31.9022 -14.5009
14 C8x C 33.1017 -16.6496
15 C8x C 25.8213 -16.6111
16 C8y C 25.8213 -19.4335
17 O1d O 32.1074 -20.8127
18 O1d O 33.5057 -19.4207
19 O1d O 32.1074 -18.0224
20 C8y C 33.1145 -15.1937
21 O1a O 31.9279 -13.1860
22 C8y C 24.6154 -17.3103
23 C8x C 24.6154 -18.7215
24 O1a O 25.8213 -20.8318
25 O2a O 34.3205 -14.5009
26 O2a O 23.4094 -16.6111
27 S4a S 35.7188 -14.5009
28 S4a S 22.0111 -16.6111
29 O1d O 35.7188 -15.8927
30 O1d O 35.7444 -13.0513
31 O1d O 37.1107 -14.5009
32 O1d O 22.0111 -15.2193
33 O1d O 20.6192 -16.6111
34 O1d O 22.0111 -18.0096
BOND 36
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 5 10 1
10 5 11 2
11 6 12 1
12 7 13 2
13 8 14 1
14 9 15 1
15 10 16 1
16 12 17 1
17 12 18 2
18 12 19 2
19 13 20 1
20 13 21 1
21 15 22 2
22 16 23 2
23 16 24 1
24 20 25 1
25 22 26 1
26 25 27 1
27 26 28 1
28 27 29 1
29 27 30 2
30 27 31 2
31 28 32 1
32 28 33 2
33 28 34 2
34 9 10 2
35 14 20 2
36 22 23 1
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