| Entry |
|
|---|
| Name |
N-3-Oxo-dodecanoyl-L-homoserine lactone;
3-Oxo-C12-HSL;
3-Oxo-N-[(3S)-tetrahydro-2-oxo-3-furanyl]-dodecanamide;
N-(3-Oxododecanoyl)-L-homoserine lactone
|
|---|
| Formula |
C16H27NO4
|
|---|
| Exact mass |
297.194
|
|---|
| Mol weight |
297.3899
|
|---|
| Structure |
|
|---|
| Pathway |
| map02025 | Biofilm formation - Pseudomonas aeruginosa |
|
|---|
| Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA08 Fatty amides
FA0803 Fatty acyl homoserine lactones
C21201 N-(3-Oxododecanoyl)-L-homoserine lactone
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 21
1 C1y C 21.7361 -15.7996
2 C1x C 22.0955 -14.3872
3 C1x C 23.4832 -14.3839
4 O7x O 23.9814 -15.6813
5 C7x C 22.9018 -16.5562
6 C1b C 18.1039 -16.4812
7 C5a C 19.3191 -15.7887
8 N1b N 20.5265 -16.4948
9 O6a O 22.8939 -17.9584
10 O5a O 19.3053 -14.3908
11 C5a C 16.9228 -15.7580
12 C1b C 15.7097 -16.4582
13 C1b C 14.5308 -15.7439
14 C1b C 13.3187 -16.4437
15 O5a O 16.9414 -14.3288
16 C1b C 12.0876 -15.7500
17 C1b C 10.8751 -16.4500
18 C1b C 9.6627 -15.7500
19 C1b C 8.4503 -16.4500
20 C1b C 7.2378 -15.7500
21 C1a C 6.0254 -16.4500
BOND 21
1 3 4 1
2 4 5 1
3 5 1 1
4 6 7 1
5 7 8 1
6 1 8 1 #Up
7 1 2 1
8 5 9 2
9 7 10 2
10 2 3 1
11 6 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 11 15 2
16 14 16 1
17 16 17 1
18 17 18 1
19 18 19 1
20 19 20 1
21 20 21 1
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|---|
