| Entry |
|
|---|
| Name |
Volicitin;
N-(17-Hydroxylinolenoyl)-L-glutamine
|
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| Formula |
C23H38N2O5
|
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| Exact mass |
422.2781
|
|---|
| Mol weight |
422.5582
|
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| Structure |
|
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| Pathway |
| map00592 | alpha-Linolenic acid metabolism |
|
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| Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA00 Other Fatty Acyls
C16345 Volicitin
|
|---|
| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 30
1 C1b C 36.7500 -24.5700
2 C1b C 35.5600 -25.2700
3 C1b C 37.9400 -25.2700
4 C2b C 34.3000 -24.5700
5 C1b C 39.2000 -24.5700
6 C2b C 32.9000 -24.5700
7 C1b C 40.3900 -25.2700
8 C1b C 31.7100 -25.2700
9 C2b C 30.5200 -24.5700
10 C2b C 29.1200 -24.5700
11 C1b C 27.9300 -25.2700
12 C2b C 26.6700 -24.5700
13 C2b C 25.2700 -24.5700
14 C1c C 24.0800 -25.2700
15 C1a C 22.8900 -24.5700
16 O1a O 24.0800 -26.6700
17 C1b C 40.3900 -26.6700
18 C1b C 39.1776 -27.3700
19 C5a C 39.1775 -28.7698
20 O5a O 37.9819 -29.4602
21 N1b N 40.4068 -29.4797
22 C1c C 40.4066 -30.8699
23 C6a C 39.1816 -31.5770
24 C1b C 41.6065 -31.5630
25 C1b C 42.7960 -30.8763
26 C5a C 43.9861 -31.5637
27 O6a O 37.9801 -30.8830
28 O6a O 39.1815 -32.9699
29 N1a N 45.1762 -30.8766
30 O5a O 43.9860 -32.9698
BOND 29
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 2
6 5 7 1
7 6 8 1
8 8 9 1
9 9 10 2
10 10 11 1
11 11 12 1
12 12 13 2
13 13 14 1
14 14 15 1
15 14 16 1
16 7 17 1
17 17 18 1
18 18 19 1
19 19 20 2
20 19 21 1
21 21 22 1 #Up
22 22 23 1
23 22 24 1
24 24 25 1
25 25 26 1
26 23 27 1
27 23 28 2
28 26 29 1
29 26 30 2
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