Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000853529 | Gold | 1!CCMSLIB00000853531 |
COMPOUND NPA016339
PROPERTIES
| NPAID | NPA016339 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | Porritoxinol |
| FORMULA | C15H20O6 |
| MOLECULAR WEIGHT (Da) | 296.3190 |
| ACCURATE MASS (Da) | 296.1260 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Alternaria |
| ORIGIN SPECIES | porri |
| InChIKey | WVJWALIKYTWYOP-LBPRGKRZSA-N |
| InChI | InChI=1S/C15H20O6/c1-8-11(20-7-12(16)15(2,3)18)5-9-10(13(8)19-4)6-21-14(9)17/h5,12,16,18H,6-7H2,1-4H3/t12-/m0/s1 |
| SMILES | CC1=C(C=C2C(=C1OC)COC2=O)OC[C@@H](C(C)(C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Suemitsu, Rikisaku; Ohnishi, Keiichiro; Morikawa, Yoshiyuki; Ideguchi, Isao; Uno, Hiroyuki Porritoxinol, a phytotoxin of Alternaria porri Phytochemistry 1994 35 (3) 603-605. | ||
|---|---|---|---|
| DOI | 10.1016/s0031-9422(00)90570-3 | PMID | - |
