Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA011581
PROPERTIES
NPAID | NPA011581 |
---|---|
CLUSTER ID | 511 |
NODE ID | 458 |
NAME | Pestalotiopsone B |
FORMULA | C20H26O5 |
MOLECULAR WEIGHT (Da) | 346.4230 |
ACCURATE MASS (Da) | 346.1780 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Pestalotiopsis |
ORIGIN SPECIES | sp. |
InChIKey | PTBADJJYGVHTHW-UHFFFAOYSA-N |
InChI | InChI=1S/C20H26O5/c1-3-5-6-7-8-9-16-13-17(22)20-14(11-19(23)24-4-2)10-15(21)12-18(20)25-16/h10,12-13,21H,3-9,11H2,1-2H3 |
SMILES | CCCCCCCC1=CC(=O)C2=C(O1)C=C(C=C2CC(=O)OCC)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Xu, Jing; Kjer, Julia; Sendker, Jandirk; Wray, Victor; Guan, Huashi; Edrada, RuAngelie; Lin, Wenhan; Wu, Jun; Proksch, Peter Chromones from the endophytic fungus Pestalotiopsis sp. isolated from the Chinese mangrove plant Rhizophora mucronata Journal of Natural Products 2009 72 (4) 662-665. | ||
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DOI | 10.1021/np800748u | PMID | 19271764 |