Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022749
PROPERTIES
| NPAID | NPA022749 |
|---|---|
| CLUSTER ID | 10 |
| NODE ID | 10 |
| NAME | Simplicildone A |
| FORMULA | C18H18O6 |
| MOLECULAR WEIGHT (Da) | 330.3360 |
| ACCURATE MASS (Da) | 330.1103 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Simplicillium |
| ORIGIN SPECIES | sp. PSU-H41 |
| InChIKey | DRJYIIBSTODYSV-UHFFFAOYSA-N |
| InChI | InChI=1S/C18H18O6/c1-8-5-13(20)11(7-22-4)17-14(8)18(21)24-16-10(3)12(19)6-9(2)15(16)23-17/h5-6,19-20H,7H2,1-4H3 |
| SMILES | CC1=CC(=C(C2=C1C(=O)OC3=C(O2)C(=CC(=C3C)O)C)COC)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Saetang, Praphatsorn; Rukachaisirikul, Vatcharin; Phongpaichit, Souwalak; Preedanon, Sita; Sakayaroj, Jariya; Borwornpinyo, Suparerk; Seemakhan, Sawinee; Muanprasat, Chatchai Depsidones and an α-pyrone derivative from Simpilcillium sp. PSU-H41, an endophytic fungus from Hevea brasiliensis leaf Phytochemistry 2017 143 115-123. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2017.08.002 | PMID | 28803995 |
