Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019154
PROPERTIES
| NPAID | NPA019154 |
|---|---|
| CLUSTER ID | 5166 |
| NODE ID | 3702 |
| NAME | Chenopodolin B |
| FORMULA | C26H32O9 |
| MOLECULAR WEIGHT (Da) | 488.5330 |
| ACCURATE MASS (Da) | 488.2046 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phoma |
| ORIGIN SPECIES | chenopodiicola |
| InChIKey | UKVZYZLTRBOIDM-NSBUEDILSA-N |
| InChI | InChI=1S/C26H32O9/c1-8-24(5)11-15-9-17(30)20-25(6,16(15)10-18(24)32-12(2)27)21(33-13(3)28)19-22(34-14(4)29)26(20,7)23(31)35-19/h8-9,16,18-22H,1,10-11H2,2-7H3/t16-,18+,19?,20+,21-,22-,24-,25+,26+/m1/s1 |
| SMILES | CC(=O)O[C@H]1C[C@@H]2C(=CC(=O)[C@H]3[C@]2([C@@H](C4[C@H]([C@]3(C(=O)O4)C)OC(=O)C)OC(=O)C)C)C[C@@]1(C)C=C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Evidente, Marco; Cimmino, Alessio; Zonno, Maria Chiara; Masi, Marco; Berestetskyi, Alexander; Santoro, Ernesto; Superchi, Stefano; Vurro, Maurizio; Evidente, Antonio Phytotoxins produced by Phoma chenopodiicola, a fungal pathogen of Chenopodium album Phytochemistry 2015 117 482-488. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2015.07.008 | PMID | 26226110 |
