| Entry |
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| Name |
9(S)-HOT;
(9S)-(10E,12Z,15Z)-9-Hydroxyoctadecatri-10,12,15-enoic acid;
9(S)-HOTrE
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| Formula |
C18H30O3
|
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| Exact mass |
294.2195
|
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| Mol weight |
294.429
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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
FA02 Octadecanoids
FA0200 Other Octadecanoids
C16326 (9S)-(10E,12Z,15Z)-9-Hydroxyoctadecatri-10,12,15-enoic acid
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 21
1 C1b C 23.8362 -20.9035
2 C1b C 25.0250 -21.6028
3 C1b C 22.6475 -21.6028
4 C1c C 26.2837 -20.9035
5 C1b C 21.3889 -20.9035
6 C1b C 20.2001 -21.6028
7 C1b C 19.0114 -20.9035
8 C1b C 17.7528 -21.6028
9 C6a C 16.5641 -20.9035
10 O6a O 15.3754 -21.6028
11 O6a O 16.5641 -19.5050
12 O1a O 26.3540 -19.5750
13 C2b C 27.5423 -21.6028
14 C2b C 28.7311 -20.9035
15 C2b C 29.9197 -21.6028
16 C2b C 31.3182 -21.6028
17 C1b C 32.5069 -20.9035
18 C2b C 33.7656 -21.6028
19 C2b C 35.1641 -21.6028
20 C1b C 36.4228 -20.9035
21 C1a C 37.6115 -21.6028
BOND 20
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 9 11 2
11 4 12 1 #Down
12 4 13 1
13 13 14 2
14 14 15 1
15 15 16 2
16 16 17 1
17 17 18 1
18 18 19 2
19 19 20 1
20 20 21 1
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