Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA008053
PROPERTIES
| NPAID | NPA008053 |
|---|---|
| CLUSTER ID | 560 |
| NODE ID | 499 |
| NAME | Tricycloalternarene 5a |
| FORMULA | C22H32O3 |
| MOLECULAR WEIGHT (Da) | 344.4950 |
| ACCURATE MASS (Da) | 344.2351 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Alternaria |
| ORIGIN SPECIES | alternata |
| InChIKey | JJBNVJUBVPIBPQ-OVCLIPMQSA-N |
| InChI | InChI=1S/C22H32O3/c1-14(2)7-6-8-15(3)16-11-12-22(4)18(16)13-17-19(23)9-10-20(24-5)21(17)25-22/h7-8,16,18,20H,6,9-13H2,1-5H3/b15-8+ |
| SMILES | CC(=CC/C=C(\C)/C1CCC2(C1CC3=C(O2)C(CCC3=O)OC)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Liebermann, Bernd; Ellinger, Renate; Guenther, Wolfgang; Ihn; Gallander Tricycloalternarenes produced by Alternaria alternata related to ACTG- toxins Phytochemistry 1997 46 (2) 297-303. | ||
|---|---|---|---|
| DOI | 10.1016/s0031-9422(97)00278-1 | PMID | - |
