| Entry |
|
|---|
| Name |
|
|---|
| Formula |
C43H58O18
|
|---|
| Exact mass |
862.3623
|
|---|
| Mol weight |
862.9098
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01057 | Biosynthesis of type II polyketide products |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK08 Angucyclines
C12411 Urdamycin F
Glycosides [BR:br08021]
O-glycosides
Anthraquinone glycosides
C12411 Urdamycin F
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 61
1 O1a O 39.8140 -22.7958
2 C1z C 38.3820 -22.7956
3 C1a C 39.0933 -24.0338
4 C1y C 18.5185 -13.8666
5 C1y C 17.3497 -14.5583
6 C1y C 17.3628 -15.9233
7 C1x C 18.5482 -16.5841
8 C1y C 19.7172 -15.8925
9 O2x O 19.7706 -14.5401
10 O2a O 20.8996 -16.5480
11 O1a O 16.1951 -16.6169
12 O1a O 16.1665 -13.8913
13 C1a C 18.5074 -12.5085
14 C1y C 22.0741 -17.2300
15 C1x C 22.0741 -18.5882
16 C1x C 23.2556 -19.2718
17 C1y C 24.4279 -18.5882
18 O2x O 24.4279 -17.2300
19 C1y C 23.2556 -16.5555
20 C1a C 23.2578 -15.1973
21 O2a O 25.6056 -19.2648
22 C1y C 27.9290 -16.5145
23 C1y C 26.7600 -17.2061
24 C1y C 26.7733 -18.5711
25 C1x C 27.9588 -19.2319
26 C1y C 29.1276 -18.5403
27 O2x O 29.1112 -17.1879
28 C8y C 30.3099 -19.1958
29 O1a O 25.5770 -16.5389
30 C1a C 27.9177 -15.1563
31 C1z C 37.2025 -20.6278
32 C1z C 35.8852 -21.3485
33 C5x C 35.8863 -22.7973
34 C1x C 37.1347 -23.5069
35 C1x C 38.3809 -21.3467
36 C2y C 34.6379 -19.1774
37 C2y C 34.6379 -20.6278
38 C1x C 37.1367 -19.1774
39 C1y C 35.8874 -18.4567
40 C8x C 30.3048 -20.6371
41 C8x C 31.3949 -21.2469
42 C8y C 32.4759 -20.6371
43 C5x C 33.5569 -21.2469
44 C8y C 31.3858 -18.5676
45 C8y C 32.4759 -19.1865
46 C5x C 33.5478 -18.5583
47 O1a O 31.3765 -17.2094
48 O5x O 33.5385 -17.2001
49 O5x O 33.5633 -22.2644
50 O5x O 34.7026 -23.4550
51 O1a O 35.8874 -17.0985
52 O1a O 38.3059 -19.9442
53 O2a O 32.9657 -23.8340
54 C1y C 29.4362 -24.5176
55 C1y C 29.4362 -25.8758
56 C1x C 30.6179 -26.5594
57 C1x C 31.7900 -25.8758
58 C1y C 31.7900 -24.5176
59 O2x O 30.6179 -23.8431
60 O1a O 28.2597 -26.5543
61 C1a C 28.2617 -23.8355
BOND 68
1 2 1 1 #Up
2 2 3 1 #Down
3 18 19 1
4 19 14 1
5 31 32 1
6 32 33 1
7 33 34 1
8 34 2 1
9 2 35 1
10 35 31 1
11 6 11 1 #Up
12 19 20 1 #Down
13 14 10 1 #Down
14 5 6 1
15 36 37 2
16 37 32 1
17 31 38 1
18 38 39 1
19 39 36 1
20 17 21 1 #Up
21 5 12 1 #Down
22 40 41 1
23 6 7 1
24 41 42 2
25 4 13 1 #Up
26 42 43 1
27 43 37 1
28 40 28 2
29 7 8 1
30 28 44 1
31 8 9 1
32 44 45 2
33 9 4 1
34 45 46 1
35 46 36 1
36 22 23 1
37 44 47 1
38 23 24 1
39 46 48 2
40 42 45 1
41 24 25 1
42 43 49 2
43 25 26 1
44 33 50 2
45 26 27 1
46 27 22 1
47 39 51 1 #Down
48 26 28 1 #Up
49 31 52 1 #Up
50 24 21 1 #Up
51 32 53 1 #Up
52 8 10 1 #Up
53 23 29 1 #Down
54 4 5 1
55 22 30 1 #Up
56 14 15 1
57 15 16 1
58 54 55 1
59 55 56 1
60 56 57 1
61 57 58 1
62 58 59 1
63 59 54 1
64 58 53 1 #Up
65 16 17 1
66 55 60 1 #Down
67 17 18 1
68 54 61 1 #Down
|
|---|
