Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022678
PROPERTIES
| NPAID | NPA022678 |
|---|---|
| CLUSTER ID | 11 |
| NODE ID | 11 |
| NAME | Peniisocoumarin F |
| FORMULA | C13H13ClO6 |
| MOLECULAR WEIGHT (Da) | 300.6940 |
| ACCURATE MASS (Da) | 300.0401 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | commune QQF-3 |
| InChIKey | YQDKBMBOGVESDO-ZCFIWIBFSA-N |
| InChI | InChI=1S/C13H13ClO6/c1-19-10-4-9(16)11-8(12(10)17)3-7(20-13(11)18)2-6(14)5-15/h3-4,6,15-17H,2,5H2,1H3/t6-/m1/s1 |
| SMILES | COC1=C(C2=C(C(=C1)O)C(=O)OC(=C2)C[C@H](CO)Cl)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel Journal of Natural Products 2018 81 (6) 1376-1383. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.7b01018 | PMID | 29792702 |
