Entry |
|
Name |
|
Formula |
C39H49NO16
|
Exact mass |
787.3051
|
Mol weight |
787.80
|
Structure |
|
Remark |
|
Pathway |
map01057 | Biosynthesis of type II polyketide products |
map01110 | Biosynthesis of secondary metabolites |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1305 Anthracyclinones
C18633 Nogalamycin
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C18633
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 56
1 C8y C 29.7196 -17.7747
2 C8y C 29.7196 -19.1850
3 C8x C 28.4504 -17.0695
4 C1y C 30.9183 -17.0695
5 C1y C 30.9183 -19.8902
6 C8y C 28.5209 -19.8902
7 C8y C 27.2516 -17.7747
8 C1z C 32.1171 -17.7042
9 C1x C 32.1171 -19.1850
10 C8y C 27.2516 -19.1850
11 O1a O 28.5209 -21.2300
12 C5x C 25.9824 -17.0695
13 O1a O 32.8222 -16.5054
14 C5x C 25.9824 -19.8902
15 C8y C 24.7836 -17.7747
16 O5x O 25.9824 -15.7297
17 C8y C 24.7836 -19.1850
18 O5x O 25.9824 -21.2300
19 C8y C 23.5849 -19.8902
20 C8y C 22.4567 -17.7747
21 C8x C 22.4567 -19.1850
22 O1a O 23.5849 -21.3004
23 O2a O 30.9183 -21.3004
24 C1a C 33.4569 -18.0568
25 C8y C 23.5849 -17.0695
26 O2x O 23.5849 -15.6594
27 C1y C 22.3157 -15.0247
28 O2x O 21.1875 -15.7297
29 C1z C 21.1875 -17.1401
30 C1y C 32.1171 -22.0056
31 O2x O 33.3158 -21.3004
32 C1y C 34.4440 -22.0056
33 C1y C 34.4440 -23.3453
34 C1z C 33.3158 -24.0505
35 C1y C 32.1171 -23.3453
36 C1a C 35.6427 -21.3004
37 O2a O 35.6427 -24.0505
38 O2a O 30.9183 -24.0505
39 C1a C 29.7196 -23.3453
40 C1a C 34.2326 -25.3903
41 O2a O 32.3286 -25.3903
42 C1a C 36.8415 -23.3453
43 C1a C 30.9888 -25.3903
44 C7a C 30.9183 -15.6572
45 O7a O 32.1202 -14.9636
46 O6a O 29.6938 -14.9501
47 C1a C 33.3349 -15.5945
48 C1y C 21.0935 -14.3191
49 C1y C 19.9652 -16.4345
50 C1y C 19.9652 -15.0232
51 C1a C 21.1875 -18.5514
52 O1a O 18.7209 -17.1530
53 N1c N 18.7169 -14.3304
54 O1a O 21.0693 -12.9158
55 C1a C 17.5266 -15.0452
56 C1a C 18.7169 -12.9192
BOND 62
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 1
8 5 9 1
9 6 10 1
10 6 11 1
11 7 12 1
12 8 13 1 #Up
13 10 14 1
14 12 15 1
15 12 16 2
16 14 17 1
17 14 18 2
18 17 19 1
19 19 21 2
20 7 10 2
21 8 9 1
22 15 17 2
23 20 21 1
24 19 22 1
25 5 23 1 #Down
26 8 24 1 #Down
27 15 25 1
28 20 25 2
29 25 26 1
30 26 27 1
31 27 28 1
32 28 29 1
33 20 29 1
34 30 23 1 #Down
35 30 31 1
36 31 32 1
37 32 33 1
38 33 34 1
39 34 35 1
40 30 35 1
41 32 36 1 #Up
42 33 37 1 #Down
43 35 38 1 #Up
44 38 39 1
45 34 41 1 #Up
46 34 40 1 #Down
47 37 42 1
48 41 43 1
49 4 44 1 #Up
50 44 45 1
51 44 46 2
52 45 47 1
53 27 48 1
54 29 49 1
55 49 50 1
56 50 48 1
57 29 51 1 #Up
58 49 52 1 #Down
59 50 53 1 #Up
60 48 54 1 #Down
61 53 55 1
62 53 56 1
|