Entry |
|
Name |
|
Formula |
C31H36N2O11
|
Exact mass |
612.2319
|
Mol weight |
612.62
|
Structure |
|
Reaction |
|
Pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Enzyme |
|
Brite |
Compounds with biological roles [BR:br08001]
Antibiotics
Others
Aromatic compounds
C05080 Novobiocin
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C05080
|
Other DBs |
|
KCF data |
ATOM 44
1 C8y C 24.9654 -13.9379
2 C8y C 24.9654 -15.3326
3 C8y C 23.7608 -13.2468
4 O7x O 26.1763 -13.2278
5 C8y C 26.1827 -16.0300
6 C8x C 23.7608 -16.0363
7 C8y C 22.5626 -13.9379
8 C1a C 23.7545 -11.8710
9 C8y C 27.4636 -13.9252
10 C8y C 27.4063 -15.3389
11 O1a O 26.1827 -17.4121
12 C8x C 22.5626 -15.3326
13 O2a O 21.3706 -13.2532
14 O6a O 28.5855 -13.2341
15 N1b N 29.0167 -15.9412
16 C1y C 20.1789 -13.9441
17 C5a C 30.2149 -15.2503
18 C1y C 20.1789 -15.3389
19 O2x O 18.9678 -13.2532
20 C8y C 31.4068 -15.9412
21 O5a O 30.2149 -13.8745
22 C1y C 18.9678 -16.0427
23 O1a O 21.3771 -16.0237
24 C1z C 17.7760 -13.9441
25 C8x C 31.4131 -17.3232
26 C8x C 32.5923 -15.2565
27 C1y C 17.7760 -15.3389
28 O7a O 18.9678 -17.4247
29 C1a C 16.9518 -12.5113
30 C1a C 16.3495 -14.2231
31 C8y C 32.5986 -18.0144
32 C8x C 33.7905 -15.9349
33 O2a O 16.5777 -16.0237
34 C7a C 17.7696 -18.1094
35 C8y C 33.7970 -17.3170
36 C1b C 32.5986 -19.3964
37 C1a C 15.1702 -16.0300
38 N1a N 17.7634 -19.4852
39 O6a O 16.5777 -17.4185
40 O1a O 34.9887 -18.0017
41 C2b C 33.7970 -20.0875
42 C2c C 33.7970 -21.4633
43 C1a C 34.9887 -22.1543
44 C1a C 32.5986 -22.1543
BOND 47
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 2
10 5 11 1
11 6 12 2
12 7 13 1
13 9 14 2
14 10 15 1
15 16 13 1 #Up
16 15 17 1
17 16 18 1
18 16 19 1
19 17 20 1
20 17 21 2
21 18 22 1
22 18 23 1 #Down
23 19 24 1
24 20 25 1
25 20 26 2
26 22 27 1
27 22 28 1 #Down
28 24 29 1
29 24 30 1
30 25 31 2
31 26 32 1
32 27 33 1 #Up
33 28 34 1
34 31 35 1
35 31 36 1
36 33 37 1
37 34 38 1
38 34 39 2
39 35 40 1
40 36 41 1
41 41 42 2
42 42 43 1
43 42 44 1
44 7 12 1
45 9 10 1
46 24 27 1
47 32 35 2
|