Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019901
PROPERTIES
| NPAID | NPA019901 |
|---|---|
| CLUSTER ID | 698 |
| NODE ID | 614 |
| NAME | Solanapyrone D |
| FORMULA | C18H22O4 |
| MOLECULAR WEIGHT (Da) | 302.3700 |
| ACCURATE MASS (Da) | 302.1518 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Alternaria |
| ORIGIN SPECIES | solani |
| InChIKey | AWQLNKJBXASXDU-IPJQOSJUSA-N |
| InChI | InChI=1S/C18H22O4/c1-11-7-8-12-5-3-4-6-13(12)17(11)16-9-15(21-2)14(10-19)18(20)22-16/h7-13,17H,3-6H2,1-2H3/t11-,12+,13-,17-/m1/s1 |
| SMILES | C[C@@H]1C=C[C@@H]2CCCC[C@H]2[C@@H]1C3=CC(=C(C(=O)O3)C=O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Oikawa, Hideaki; Yokota, Tomohiro; Ichihara, Akitami; Sakamura, Sadao Structure and absolute configuration of solanapyrone D: a new clue to the occurrence of biological Diels-Alder reactions Journal of the Chemical Society, Chemical Communications 1989 (17) 1284-1285. | ||
|---|---|---|---|
| DOI | 10.1039/c39890001284 | PMID | - |
