| Entry |
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| Name |
Abscisic acid glucose ester;
Abscisic acid-beta-D-glucopyranosyl ester;
beta-D-Glucopyranosyl abscisate
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| Formula |
C21H30O9
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| Exact mass |
426.189
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| Mol weight |
426.4575
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| Structure |
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| Reaction |
|
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| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
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| Enzyme |
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| Brite |
Lipids [BR:br08002]
PR Prenol lipids
PR01 Isoprenoids
PR0103 C15 isoprenoids (sesquiterpenes)
PR010305 Cyclofarnesane sesquiterpenoids
C15970 Abscisic acid glucose ester
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| Other DBs |
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| KCF data |
ATOM 30
1 C1z C 20.2712 -17.0132
2 C1z C 19.0518 -16.3071
3 C2y C 20.2647 -18.4185
4 C2b C 21.4904 -16.3136
5 O1a O 21.4713 -17.7125
6 C1x C 17.8324 -17.0132
7 C2x C 19.0518 -19.1115
8 C1a C 21.4776 -19.1180
9 C2b C 22.6970 -17.0195
10 C5x C 17.8324 -18.4185
11 C2c C 23.9164 -16.3199
12 O5x O 16.6196 -19.1052
13 C2b C 25.1229 -17.0323
14 C1a C 23.9099 -14.9081
15 C7a C 25.1164 -18.4378
16 O7a O 26.3165 -19.1309
17 O6a O 23.8970 -19.1244
18 C1y C 27.5302 -19.8317
19 O2x O 27.5302 -21.2332
20 C1y C 28.7440 -21.9339
21 C1y C 29.9576 -21.2332
22 C1y C 29.9576 -19.8317
23 C1y C 28.7440 -19.1309
24 C1b C 28.7440 -23.3374
25 O1a O 27.5245 -24.0414
26 O1a O 31.1495 -21.9216
27 O1a O 31.1478 -19.1443
28 O1a O 28.7440 -17.7315
29 C1a C 19.7518 -15.0947
30 C1a C 18.0619 -15.3172
BOND 31
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1 #Down
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 2
9 6 10 1
10 9 11 1
11 10 12 2
12 11 13 2
13 11 14 1
14 13 15 1
15 15 16 1
16 15 17 2
17 7 10 1
18 18 16 1 #Up
19 18 19 1
20 19 20 1
21 20 21 1
22 21 22 1
23 22 23 1
24 18 23 1
25 20 24 1 #Up
26 24 25 1
27 21 26 1 #Down
28 22 27 1 #Up
29 23 28 1 #Down
30 2 29 1
31 2 30 1
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