| Entry |
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| Name |
6,8a-Seco-6,8a-deoxy-5-oxoavermectin ''1a'' aglycone
|
|---|
| Formula |
C34H48O7
|
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| Exact mass |
568.3400
|
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| Mol weight |
568.74
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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 |
1.14.-.-
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C11977 6,8a-Seco-6,8a-deoxy-5-oxoavermectin ''1a'' aglycone
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 41
1 C1z C 25.3828 -15.9914
2 O2x O 26.5884 -16.6882
3 C1y C 27.7945 -15.9928
4 C1y C 27.7953 -14.6003
5 C2x C 26.5897 -13.9035
6 C2x C 25.3836 -14.5992
7 C1x C 21.7428 -15.2947
8 C2x C 20.5277 -15.9914
9 C2y C 19.3112 -15.2894
10 C1y C 18.0947 -15.9914
11 C1y C 18.0947 -17.3961
12 C1y C 22.9583 -15.9914
13 C1x C 25.3849 -17.4065
14 O2x O 24.1777 -15.2944
15 C1y C 24.1655 -18.1035
16 C1x C 22.9599 -17.3985
17 O7x O 24.1578 -19.5005
18 C2x C 19.3144 -18.0964
19 C2x C 19.3144 -19.4971
20 C2x C 20.5255 -20.1899
21 C2y C 20.5178 -21.5882
22 C7x C 22.9477 -20.2031
23 C1y C 22.9400 -21.6014
24 C1z C 21.7298 -22.2889
25 C1x C 21.7200 -23.6806
26 C5x C 22.9203 -24.3851
27 C2y C 24.1307 -23.6976
28 C2x C 24.1403 -22.3059
29 C1a C 19.3112 -13.8847
30 O1a O 16.8784 -15.2894
31 C1a C 16.8792 -18.0998
32 C1a C 19.2992 -22.2868
33 O1a O 21.8510 -20.8800
34 O5x O 22.9105 -25.7895
35 C1a C 25.3422 -24.4084
36 O6a O 21.7322 -19.4989
37 C1a C 29.0121 -13.8985
38 C1c C 29.0108 -16.6956
39 C1a C 29.0100 -18.1001
40 C1b C 30.2275 -15.9938
41 C1a C 31.4435 -16.6967
BOND 44
1 19 20 1
2 4 5 1
3 8 9 2
4 9 10 1
5 20 21 2
6 21 24 1
7 23 22 1 #Down
8 10 11 1
9 11 18 1
10 5 6 2
11 1 6 1 #Up
12 12 16 1
13 23 24 1
14 24 25 1
15 25 26 1
16 26 27 1
17 27 28 2
18 28 23 1
19 15 13 1
20 9 29 1
21 13 1 1
22 10 30 1 #Down
23 1 14 1
24 11 31 1 #Down
25 14 12 1
26 21 32 1
27 12 7 1 #Up
28 24 33 1 #Down
29 7 8 1
30 26 34 2
31 1 2 1 #Down
32 27 35 1
33 15 16 1
34 22 36 2
35 22 17 1
36 4 37 1 #Down
37 15 17 1 #Up
38 3 38 1 #Up
39 2 3 1
40 38 39 1
41 3 4 1
42 38 40 1
43 18 19 2
44 40 41 1
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