Entry |
|
Name |
|
Formula |
C35H56O14
|
Exact mass |
700.367
|
Mol weight |
700.8107
|
Structure |
|
Sequence |
0 Mak 1 Mtd 2 Mad 3 Man 4 Mte 5 Mtk 6 Mtn 7 Man |
Gene |
|
Organism |
Streptomyces bikiniensis |
Type |
PK |
Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C15678 Chalcomycin
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 49
1 C5x C 22.8290 -16.5972
2 C2x C 22.8290 -17.9976
3 C1a C 24.0193 -18.6979
4 C1y C 25.2798 -17.9976
5 C1x C 25.2798 -16.5972
6 C1z C 24.0193 -15.8969
7 C2x C 21.6385 -18.6979
8 C1y C 21.6385 -20.0983
9 C2x C 25.2798 -20.7986
10 C1y C 26.4702 -20.0983
11 C1y C 26.4702 -18.6979
12 O7x O 22.8290 -22.1991
13 C7x C 24.0193 -22.8993
14 C2x C 25.2798 -22.1991
15 C1y C 20.3782 -20.7986
16 C1y C 20.3782 -22.1991
17 C1y C 21.6385 -22.8993
18 C1a C 27.6606 -20.7986
19 C1b C 19.1877 -22.8993
20 O2x O 20.3782 -19.3982
21 O5x O 21.6385 -15.8969
22 O1a O 24.9997 -14.9166
23 C1a C 23.0391 -14.9166
24 O2a O 27.6606 -17.9976
25 O6a O 24.0193 -24.2998
26 C1a C 21.6385 -24.2998
27 C1y C 29.7614 -19.1881
28 C1y C 31.1619 -19.1881
29 C1x C 31.8622 -17.9976
30 C1y C 31.1619 -16.7373
31 O2x O 29.7614 -16.7373
32 C1y C 29.0611 -17.9976
33 O1a O 29.0611 -20.3784
34 O2a O 31.8622 -20.3784
35 C1a C 33.2626 -20.3784
36 C1a C 31.8622 -15.5468
37 O2a O 17.9692 -22.2090
38 C1y C 16.7874 -22.9043
39 O2x O 15.5816 -22.2211
40 C1y C 14.3745 -22.9311
41 C1y C 14.3158 -24.3316
42 C1y C 15.5916 -25.0148
43 C1y C 16.7987 -24.3047
44 O2a O 18.0212 -24.9975
45 C1a C 18.0212 -26.3979
46 O2a O 15.6031 -26.4004
47 C1a C 14.4061 -27.1049
48 O1a O 13.1711 -25.0464
49 C1a C 13.1282 -22.2256
BOND 52
1 1 2 1
2 4 3 1 #Up
3 4 5 1
4 5 6 1
5 1 6 1
6 2 7 2
7 7 8 1
8 9 10 1
9 10 11 1
10 4 11 1
11 12 13 1
12 13 14 1
13 14 9 2
14 8 15 1
15 15 16 1
16 16 17 1
17 17 12 1
18 10 18 1 #Up
19 16 19 1 #Up
20 15 20 1 #Up
21 8 20 1 #Up
22 1 21 2
23 6 22 1 #Up
24 6 23 1 #Down
25 11 24 1 #Down
26 13 25 2
27 17 26 1 #Down
28 27 28 1
29 28 29 1
30 29 30 1
31 30 31 1
32 31 32 1
33 27 32 1
34 27 33 1 #Up
35 28 34 1 #Down
36 34 35 1
37 30 36 1 #Down
38 32 24 1 #Down
39 19 37 1
40 38 37 1 #Up
41 38 39 1
42 39 40 1
43 40 41 1
44 41 42 1
45 42 43 1
46 38 43 1
47 43 44 1 #Down
48 44 45 1
49 42 46 1 #Down
50 46 47 1
51 41 48 1 #Down
52 40 49 1 #Up
|