Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022752
PROPERTIES
| NPAID | NPA022752 |
|---|---|
| CLUSTER ID | 11 |
| NODE ID | 11 |
| NAME | Setosphapyrone D |
| FORMULA | C12H16O5 |
| MOLECULAR WEIGHT (Da) | 240.2550 |
| ACCURATE MASS (Da) | 240.0998 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Setosphaeria |
| ORIGIN SPECIES | sp. SCSIO41009 |
| InChIKey | NKTLEOWEOOHFNG-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H16O5/c1-8-9(5-4-6-11(13)16-3)10(15-2)7-12(14)17-8/h7H,4-6H2,1-3H3 |
| SMILES | CC1=C(C(=CC(=O)O1)OC)CCCC(=O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pang, Xiaoyan; Lin, Xiuping; Yang, Jie; Zhou, Xuefeng; Yang, Bin; Wang, Junfeng; Liu, Yonghong Spiro-Phthalides and Isocoumarins Isolated from the Marine-Sponge-Derived Fungus Setosphaeria sp. SCSIO41009. Journal of Natural Products 2018 81 (8) 1860-1868. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.8b00345 | PMID | 30091601 |
