Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA005448
PROPERTIES
NPAID | NPA005448 |
---|---|
CLUSTER ID | 151 |
NODE ID | 143 |
NAME | Paleic acid |
FORMULA | C18H34O3 |
MOLECULAR WEIGHT (Da) | 298.4670 |
ACCURATE MASS (Da) | 298.2508 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Paenibacillus |
ORIGIN SPECIES | sp. BMK771-AF3 |
InChIKey | UTLBSLGWELAEAY-MAVJXHJTSA-N |
InChI | InChI=1S/C18H34O3/c1-2-17(19)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(20)21/h3,5,17,19H,2,4,6-16H2,1H3,(H,20,21)/b5-3-/t17-/m1/s1 |
SMILES | CC[C@H](CCCCC/C=C\CCCCCCCC(=O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Kurata, Ikuko; Umekita, Maya; Sawa, Tsutomu; Hattori, Seiko; Hayashi, Chigusa; Kinoshita, Naoko; Homma, Yoshiko; Igarashi, Masayuki; Hamada, Masa; Watanabe, Takumi; Sawa, Ryuichi; Naganawa, Hiroshi; Takahashi, Yoshikazu; Akamatsu, Yuzuru Paleic acid, a fatty acid from Paenibacillus sp.: Taxonomy, fermentation, isolation, structure determination, and anti-Mannheimia and-Pasteurella activity Journal of Antibiotics 2010 63 (8) 519-523. | ||
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DOI | 10.1038/ja.2010.90 | PMID | 20664607 |