| Entry |
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| Name |
(-)-Maackiain-3-O-glucosyl-6''-O-malonate
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| Formula |
C25H24O13
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| Exact mass |
532.1217
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| Mol weight |
532.45
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| Structure |
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| Reaction |
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| Pathway |
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| Enzyme |
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1207 Pterocarpans
C16231 (-)-Maackiain-3-O-glucosyl-6''-O-malonate
Phytochemical compounds [BR:br08003]
Flavonoids
Isoflavonoids
Pterocarpans
C16231 (-)-Maackiain-3-O-glucosyl-6''-O-malonate
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 38
1 C8y C 36.5400 -29.4000
2 C8x C 36.5400 -30.8000
3 C8x C 37.7524 -31.5000
4 C8y C 38.9649 -30.8000
5 C8y C 38.9649 -29.4000
6 C8x C 37.7524 -28.7000
7 C1y C 40.1773 -31.5000
8 C1y C 41.3897 -30.8000
9 C1x C 41.3897 -29.4000
10 O2x O 40.1773 -28.7000
11 O2x O 40.4684 -32.8694
12 C8y C 41.8607 -33.0158
13 C8y C 42.4302 -31.7368
14 C8x C 42.6836 -34.1484
15 C8y C 44.0760 -34.0020
16 C8y C 44.6454 -32.7231
17 C8x C 43.8225 -31.5904
18 O2x O 45.1164 -34.9388
19 C1x C 46.3288 -34.2388
20 O2x O 46.0377 -32.8694
21 O2a O 35.3276 -28.7000
22 C1y C 34.1321 -29.3904
23 O2x O 32.9447 -28.7049
24 C1y C 31.7323 -29.4050
25 C1y C 31.7324 -30.8050
26 C1y C 32.9197 -31.4904
27 C1y C 34.1321 -30.7904
28 C1b C 30.5010 -28.6940
29 O1a O 32.9199 -32.8999
30 O1a O 30.5055 -31.5136
31 O1a O 35.3696 -31.5049
32 O7a O 29.3003 -29.3873
33 C7a C 28.1157 -28.7033
34 C1b C 26.9230 -29.3920
35 O6a O 28.1156 -27.3002
36 C6a C 25.7343 -28.7057
37 O6a O 24.5437 -29.3932
38 O6a O 25.7341 -27.3002
BOND 43
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 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 7 11 1
13 11 12 1
14 12 13 1
15 8 13 1
16 12 14 2
17 14 15 1
18 15 16 2
19 16 17 1
20 13 17 2
21 15 18 1
22 18 19 1
23 19 20 1
24 16 20 1
25 1 21 1
26 22 21 1 #Up
27 22 23 1
28 23 24 1
29 24 25 1
30 25 26 1
31 26 27 1
32 22 27 1
33 24 28 1 #Up
34 26 29 1 #Up
35 25 30 1 #Down
36 27 31 1 #Down
37 28 32 1
38 32 33 1
39 33 34 1
40 33 35 2
41 34 36 1
42 36 37 1
43 36 38 2
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