Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016179
PROPERTIES
NPAID | NPA016179 |
---|---|
CLUSTER ID | 46 |
NODE ID | 11 |
NAME | 6-methylcurvulinic acid |
FORMULA | C11H12O5 |
MOLECULAR WEIGHT (Da) | 224.2120 |
ACCURATE MASS (Da) | 224.0685 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Penicillium |
ORIGIN SPECIES | citrinum |
InChIKey | RLDOSQILCSICAK-UHFFFAOYSA-N |
InChI | InChI=1S/C11H12O5/c1-5-8(13)3-7(4-9(14)15)10(6(2)12)11(5)16/h3,13,16H,4H2,1-2H3,(H,14,15) |
SMILES | CC1=C(C=C(C(=C1O)C(=O)C)CC(=O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | El-Neketi, Mona; Ebrahim, Weaam; Lin, Wenhan; Gedara, Sahar; Badria, Farid; Saad, Hassan-Elrady A.; Lai, Daowan; Proksch, Peter Alkaloids and polyketides from Penicillium citrinum, an endophyte isolated from the Moroccan plant Ceratonia siliqua Journal of Natural Products 2013 76 (6) 1099-1104. | ||
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DOI | 10.1021/np4001366 | PMID | 23713692 |