Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA019353
PROPERTIES
NPAID | NPA019353 |
---|---|
CLUSTER ID | 6244 |
NODE ID | 4341 |
NAME | Norbotrydialone acetate |
FORMULA | C16H22O4 |
MOLECULAR WEIGHT (Da) | 278.3480 |
ACCURATE MASS (Da) | 278.1518 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Botrytis |
ORIGIN SPECIES | cinerea |
InChIKey | OMZUEHMZFLBHNI-PCKWUFTNSA-N |
InChI | InChI=1S/C16H22O4/c1-8-6-10(19-9(2)17)12-13-11(8)14(18)20-16(13,5)7-15(12,3)4/h8,10,12H,6-7H2,1-5H3/t8-,10+,12-,16-/m1/s1 |
SMILES | C[C@@H]1C[C@@H]([C@@H]2C3=C1C(=O)O[C@@]3(CC2(C)C)C)OC(=O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Colmenares, Ana J.; Duran-Patron, Rosa M.; Hernandez-Galan, Rosario; Collado, Isidro G. Four new lactones from Botrytis cinerea Journal of Natural Products 2002 65 (11) 1724-1726. | ||
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DOI | 10.1021/np020107v | PMID | 12444715 |