Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018311
PROPERTIES
| NPAID | NPA018311 |
|---|---|
| CLUSTER ID | 6028 |
| NODE ID | 4221 |
| NAME | 10-Oxodihydrobotry-1(9),4(5)-diendial |
| FORMULA | C15H20O2 |
| MOLECULAR WEIGHT (Da) | 232.3230 |
| ACCURATE MASS (Da) | 232.1463 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Botrytis |
| ORIGIN SPECIES | cinerea |
| InChIKey | PCEVLQFNPPWJEB-RFAUZJTJSA-N |
| InChI | InChI=1S/C15H20O2/c1-9-5-6-10-12-11(9)13(16)17-8-15(12,4)7-14(10,2)3/h6,9H,5,7-8H2,1-4H3/t9-,15-/m1/s1 |
| SMILES | C[C@@H]1CC=C2C3=C1C(=O)OC[C@]3(CC2(C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Colmenares, Ana J.; Duran-Patron, Rosa M.; Hernandez-Galan, Rosario; Collado, Isidro G. Four new lactones from Botrytis cinerea Journal of Natural Products 2002 65 (11) 1724-1726. | ||
|---|---|---|---|
| DOI | 10.1021/np020107v | PMID | 12444715 |
