| Entry |
|
|---|
| Name |
Avermectin B1b monosaccharide
|
|---|
| Formula |
C40H58O11
|
|---|
| Exact mass |
714.3979
|
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| Mol weight |
714.88
|
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| Structure |
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| Reaction |
|
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| Pathway |
| map00522 | Biosynthesis of 12-, 14- and 16-membered macrolides |
| map01110 | Biosynthesis of secondary metabolites |
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| Module |
| M00777 | Avermectin biosynthesis, 2-methylbutanoyl-CoA/isobutyryl-CoA => 6,8a-Seco-6,8a-deoxy-5-oxoavermectin 1a/1b aglycone => avermectin A1a/B1a/A1b/B1b |
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| Enzyme |
2.4.1.-
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C11965 Avermectin B1b monosaccharide
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 51
1 C1z C 32.2174 -15.7701
2 O2x O 33.4069 -16.4575
3 C1y C 34.5969 -15.7711
4 C1y C 34.5977 -14.3975
5 C2x C 33.4082 -13.7100
6 C2x C 32.2181 -14.3962
7 C1x C 28.6261 -15.0826
8 C2x C 27.4272 -15.7701
9 C2y C 26.2269 -15.0771
10 C1y C 25.0267 -15.7701
11 C1y C 25.0267 -17.1560
12 C1y C 29.8253 -15.7701
13 C1x C 32.2195 -17.1662
14 O2x O 31.0284 -15.0823
15 C1y C 31.0163 -17.8539
16 C1x C 29.8268 -17.1583
17 O7x O 31.0087 -19.2320
18 C2x C 26.2301 -17.8468
19 C2x C 26.2301 -19.2288
20 C2x C 27.4251 -19.9121
21 C2y C 27.4175 -21.2920
22 C7x C 29.8148 -19.9254
23 C1y C 29.8072 -21.3051
24 C1z C 28.6133 -21.9834
25 C1y C 28.6036 -23.3564
26 C1y C 29.7878 -24.0512
27 C2y C 30.9820 -23.3732
28 C2x C 30.9915 -21.9999
29 C1a C 26.2269 -13.6915
30 O2a O 23.8265 -15.0771
31 C1a C 23.8975 -17.9902
32 C1x C 26.2151 -21.9810
33 O1a O 28.7347 -20.5933
34 O1a O 29.7781 -25.4371
35 C1a C 32.1773 -24.0745
36 O6a O 28.6156 -19.2307
37 C1a C 35.7982 -13.7051
38 C1c C 35.7969 -16.4646
39 C1a C 35.7961 -17.8505
40 C1a C 36.9973 -15.7724
41 O2x O 26.2639 -23.3648
42 C1y C 20.2386 -15.7701
43 C1y C 20.2386 -17.1560
44 C1y C 21.4375 -17.8542
45 C1x C 22.6367 -17.1560
46 C1y C 22.6367 -15.7701
47 O2x O 21.4375 -15.0826
48 C1a C 19.0394 -15.0753
49 O2a O 21.4375 -19.2401
50 O1a O 19.0370 -17.8466
51 C1a C 22.6377 -19.9330
BOND 56
1 12 16 1
2 23 24 1
3 24 25 1
4 25 26 1
5 26 27 1
6 27 28 2
7 28 23 1
8 15 13 1
9 9 29 1
10 13 1 1
11 10 30 1 #Down
12 1 14 1
13 11 31 1 #Down
14 14 12 1
15 21 32 1
16 12 7 1 #Up
17 24 33 1 #Down
18 7 8 1
19 26 34 1 #Up
20 1 2 1 #Down
21 27 35 1
22 15 16 1
23 22 36 2
24 22 17 1
25 4 37 1 #Down
26 15 17 1 #Up
27 3 38 1 #Up
28 2 3 1
29 38 39 1
30 3 4 1
31 38 40 1
32 18 19 2
33 32 41 1
34 25 41 1
35 19 20 1
36 4 5 1
37 8 9 2
38 9 10 1
39 20 21 2
40 21 24 1
41 42 43 1
42 43 44 1
43 44 45 1
44 45 46 1
45 46 47 1
46 47 42 1
47 23 22 1 #Down
48 42 48 1 #Down
49 10 11 1
50 44 49 1 #Down
51 11 18 1
52 43 50 1 #Up
53 5 6 2
54 49 51 1
55 46 30 1 #Up
56 1 6 1 #Up
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