Entry |
|
Name |
Avermectin A2a monosaccharide
|
Formula |
C42H64O12
|
Exact mass |
760.4398
|
Mol weight |
760.95
|
Structure |
|
Reaction |
|
Pathway |
map00522 | Biosynthesis of 12-, 14- and 16-membered macrolides |
|
Enzyme |
2.4.1.-
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C11974 Avermectin A2a monosaccharide
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 54
1 C1z C 31.6342 -16.1126
2 O2x O 32.8242 -16.8004
3 C1y C 34.0146 -16.1137
4 C1y C 34.0152 -14.7393
5 C1y C 32.8255 -14.0515
6 C1x C 31.6347 -14.7382
7 C1x C 28.0415 -15.4249
8 C2x C 26.8418 -16.1126
9 C2y C 25.6414 -15.4194
10 C1y C 24.4407 -16.1126
11 C1y C 24.4407 -17.4988
12 C1y C 29.2409 -16.1126
13 C1x C 31.6363 -17.5090
14 O2x O 30.4445 -15.4244
15 C1y C 30.4327 -18.1973
16 C1x C 29.2425 -17.5012
17 O7x O 30.4251 -19.5759
18 C2x C 25.6445 -18.1900
19 C2x C 25.6445 -19.5725
20 C2x C 26.8400 -20.2563
21 C2y C 26.8324 -21.6365
22 C7x C 29.2307 -20.2694
23 C1y C 29.2231 -21.6498
24 C1z C 28.0284 -22.3281
25 C1y C 28.0190 -23.7020
26 C1y C 29.2037 -24.3971
27 C2y C 30.3981 -23.7185
28 C2x C 30.4078 -22.3449
29 C1a C 25.6414 -14.0329
30 O2a O 23.2400 -15.4194
31 C1a C 23.3108 -18.3336
32 C1x C 25.6296 -22.3260
33 O1a O 28.1501 -20.9375
34 O2a O 29.1940 -25.7835
35 C1a C 31.5938 -24.4201
36 O6a O 28.0310 -19.5746
37 C1a C 35.2161 -14.0468
38 C1c C 35.2148 -16.8074
39 C1a C 35.2143 -18.1939
40 C1b C 36.4158 -16.1147
41 C1a C 37.6162 -16.8085
42 O2x O 25.6084 -23.7104
43 C1a C 30.3897 -26.4851
44 C1y C 19.6397 -16.1126
45 C1y C 19.6397 -17.4988
46 C1y C 20.8391 -18.1976
47 C1x C 22.0388 -17.4988
48 C1y C 22.0388 -16.1126
49 O2x O 20.8391 -15.4249
50 C1a C 18.4401 -15.4176
51 O2a O 20.8391 -19.5840
52 O1a O 18.4377 -18.1897
53 C1a C 22.0398 -20.2770
54 O1a O 32.8260 -12.6654
BOND 59
1 24 25 1
2 25 26 1
3 26 27 1
4 27 28 2
5 28 23 1
6 15 13 1
7 9 29 1
8 13 1 1
9 10 30 1 #Down
10 1 14 1
11 11 31 1 #Down
12 14 12 1
13 21 32 1
14 12 7 1 #Up
15 24 33 1 #Down
16 7 8 1
17 26 34 1 #Up
18 1 2 1 #Down
19 27 35 1
20 15 16 1
21 22 36 2
22 22 17 1
23 4 37 1 #Down
24 15 17 1 #Up
25 3 38 1 #Up
26 2 3 1
27 38 39 1
28 3 4 1
29 38 40 1
30 18 19 2
31 40 41 1
32 19 20 1
33 32 42 1
34 25 42 1
35 4 5 1
36 34 43 1
37 8 9 2
38 9 10 1
39 20 21 2
40 21 24 1
41 23 22 1 #Down
42 10 11 1
43 44 45 1
44 45 46 1
45 46 47 1
46 47 48 1
47 48 49 1
48 49 44 1
49 11 18 1
50 44 50 1 #Down
51 5 6 1
52 46 51 1 #Down
53 1 6 1 #Up
54 45 52 1 #Up
55 51 53 1
56 48 30 1 #Up
57 12 16 1
58 5 54 1 #Down
59 23 24 1
|