Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001583
PROPERTIES
| NPAID | NPA001583 |
|---|---|
| CLUSTER ID | 22 |
| NODE ID | 21 |
| NAME | 15-O-desmethyl-5Z-7-oxozeaenol |
| FORMULA | C18H20O7 |
| MOLECULAR WEIGHT (Da) | 348.3510 |
| ACCURATE MASS (Da) | 348.1209 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phoma |
| ORIGIN SPECIES | sp. MSX 63935 |
| InChIKey | PVEKMPNUMRVXDU-DWCLIQAISA-N |
| InChI | InChI=1S/C18H20O7/c1-10-4-2-6-13(20)17(23)14(21)7-3-5-11-8-12(19)9-15(22)16(11)18(24)25-10/h2-3,5-6,8-10,14,17,19,21-23H,4,7H2,1H3/b5-3+,6-2-/t10-,14-,17+/m0/s1 |
| SMILES | C[C@H]1C/C=C\C(=O)[C@H]([C@H](C/C=C/C2=CC(=CC(=C2C(=O)O1)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ayers, Sloan; Graf, Tyler N.; Adcock, Audrey F.; Kroll, David J.; Matthew, Susan; Carcache De Blanco, Esperanza J.; Shen, Qi; Swanson, Steven M.; Wani, Mansukh C.; Pearce, Cedric J.; Oberlies, Nicholas H. Resorcylic acid lactones with cytotoxic and NF-κB inhibitory activities and their structure-activity relationships Journal of Natural Products 2011 74 (5) 1126-1131. | ||
|---|---|---|---|
| DOI | 10.1021/np200062x | PMID | 21513293 |
