| Entry |
|
|---|
| Name |
Butrin;
Butin 7,3'-di-O-glucoside
|
|---|
| Formula |
C27H32O15
|
|---|
| Exact mass |
596.1741
|
|---|
| Mol weight |
596.534
|
|---|
| Structure |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1214 Flavanones
C09616 Butrin
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Flavanones
C09616 Butrin
Glycosides [BR:br08021]
O-glycosides
Flavonoid glycosides
Flavanones
C09616 Butrin
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C09616
|
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| Other DBs |
|
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| LinkDB |
|
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| KCF data |
ATOM 42
1 C8y C 25.2559 -18.1525
2 C8y C 25.2502 -19.5451
3 O2x O 26.4680 -17.4590
4 C8x C 24.0499 -17.4533
5 C5x C 26.4563 -20.2501
6 C8x C 24.0499 -20.2443
7 C1y C 27.6683 -18.1642
8 C8y C 22.8495 -18.1525
9 C1x C 27.6625 -19.5567
10 O5x O 26.4504 -21.6369
11 C8x C 22.8495 -19.5451
12 O2a O 21.6492 -17.4590
13 C1y C 20.2157 -18.1525
14 O2x O 19.0212 -17.4533
15 C1y C 20.2157 -19.5393
16 C1y C 17.8093 -18.1525
17 C1y C 19.0212 -20.2386
18 O1a O 21.4160 -20.2386
19 C1y C 17.8093 -19.5393
20 C1b C 16.6089 -17.4649
21 O1a O 19.0212 -21.6252
22 O1a O 16.6089 -20.2386
23 O1a O 15.4086 -18.1525
24 C8y C 28.8803 -17.4649
25 C8x C 28.8803 -16.0722
26 C8x C 30.0923 -18.1699
27 C8y C 30.0982 -15.3789
28 C8x C 31.2984 -17.4707
29 O2a O 30.0982 -13.9921
30 C8y C 31.3044 -16.0781
31 C1y C 28.7580 -13.0598
32 O1a O 32.5046 -15.3906
33 O2x O 28.7404 -11.6730
34 C1y C 27.5635 -13.7648
35 C1y C 27.5226 -10.9912
36 C1y C 26.3573 -13.0948
37 O1a O 27.5809 -15.1516
38 C1y C 26.4040 -11.7080
39 C1b C 27.5052 -9.6071
40 O1a O 25.1628 -13.8057
41 O1a O 25.1219 -11.0262
42 O1a O 28.7054 -8.9038
BOND 46
1 16 20 1 #Up
2 17 21 1 #Up
3 19 22 1 #Down
4 20 23 1
5 7 9 1
6 8 11 1
7 17 19 1
8 7 24 1 #Down
9 1 2 2
10 1 3 1
11 1 4 1
12 2 5 1
13 2 6 1
14 3 7 1
15 4 8 2
16 5 9 1
17 5 10 2
18 6 11 2
19 8 12 1
20 13 12 1 #Up
21 13 14 1
22 13 15 1
23 14 16 1
24 15 17 1
25 15 18 1 #Down
26 16 19 1
27 24 25 1
28 24 26 2
29 25 27 2
30 26 28 1
31 27 29 1
32 27 30 1
33 31 29 1 #Up
34 30 32 1
35 31 33 1
36 31 34 1
37 33 35 1
38 34 36 1
39 34 37 1 #Down
40 35 38 1
41 35 39 1 #Up
42 36 40 1 #Up
43 38 41 1 #Down
44 39 42 1
45 28 30 2
46 36 38 1
|
|---|
