Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006819
PROPERTIES
| NPAID | NPA006819 |
|---|---|
| CLUSTER ID | 55 |
| NODE ID | 51 |
| NAME | BCA 5 |
| FORMULA | C22H32O4 |
| MOLECULAR WEIGHT (Da) | 360.4940 |
| ACCURATE MASS (Da) | 360.2301 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Alternaria |
| ORIGIN SPECIES | alternata |
| InChIKey | CKTFDSDDVYJNBS-NVNXTCNLSA-N |
| InChI | InChI=1S/C22H32O4/c1-14(2)7-6-8-15(3)16-11-12-22(4,25)18(16)13-17-19(23)9-10-20(26-5)21(17)24/h7-8,11,18,20,24-25H,6,9-10,12-13H2,1-5H3/b15-8- |
| SMILES | CC(=CC/C=C(/C)\C1=CCC(C1CC2=C(C(CCC2=O)OC)O)(C)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Liebermann, Bernd; Nussbaum, Ralph-Peter; Guenther, Wolfgang Bicycloalternarenes produced by the phytopathogenic fungus Alternaria alternata Phytochemistry 2000 55 (8) 987-992. | ||
|---|---|---|---|
| DOI | 10.1016/s0031-9422(00)00268-5 | PMID | - |
