Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA009690
PROPERTIES
NPAID | NPA009690 |
---|---|
CLUSTER ID | 3986 |
NODE ID | 2973 |
NAME | Paecilomycin D |
FORMULA | C19H26O9 |
MOLECULAR WEIGHT (Da) | 398.4080 |
ACCURATE MASS (Da) | 398.1577 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Paecilomyces |
ORIGIN SPECIES | sp. SC0924 |
InChIKey | HINFKBVOBBHDCP-VENKKAMJSA-N |
InChI | InChI=1S/C19H26O9/c1-9(20)4-3-5-12(21)17(25)14(23)8-15(24)18-11-6-10(27-2)7-13(22)16(11)19(26)28-18/h3,5-7,9,12,14-15,17-18,20-25H,4,8H2,1-2H3/b5-3+/t9-,12+,14-,15+,17+,18-/m0/s1 |
SMILES | C[C@@H](C/C=C/[C@H]([C@H]([C@H](C[C@H]([C@@H]1C2=CC(=CC(=C2C(=O)O1)O)OC)O)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Xu, Liangxiong; He, Zhengxiang; Xue, Jinghua; Chen, Xiaoping; Wei, Xiaoyi β-Resorcylic acid lactones from a Paecilomyces fungus Journal of Natural Products 2010 73 (5) 885-889. | ||
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DOI | 10.1021/np900853n | PMID | 20429578 |