Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA023754
PROPERTIES
| NPAID | NPA023754 |
|---|---|
| CLUSTER ID | 6829 |
| NODE ID | 4719 |
| NAME | (4S,5S,7R,8R)-eremophil-9-ene-8,11-diol |
| FORMULA | C15H26O2 |
| MOLECULAR WEIGHT (Da) | 238.3710 |
| ACCURATE MASS (Da) | 238.1933 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Botrytis |
| ORIGIN SPECIES | cinerea |
| InChIKey | VYLHYKHUCVHIKW-ZGFBFQLVSA-N |
| InChI | InChI=1S/C15H26O2/c1-10-6-5-7-11-8-13(16)12(14(2,3)17)9-15(10,11)4/h8,10,12-13,16-17H,5-7,9H2,1-4H3/t10-,12+,13+,15-/m0/s1 |
| SMILES | C[C@H]1CCCC2=C[C@H]([C@@H](C[C@@]12C)C(C)(C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Suárez, Ivonne; da Silva Lima, Gesiane; Conti, Raphael; Pinedo, Cristina; Moraga, Javier; Barúa, Javier; de Oliveira, Ana Ligia L.; Aleu, Josefina; Durán-Patrón, Rosa; Macías-Sánchez, Antonio J.; Hanson, James R.; Tallarico Pupo, Mônica; Hernández-Galán, Rosario; Collado, Isidro G. Structural and biosynthetic studies on eremophilenols related to the phytoalexin capsidiol, produced by Botrytis cinerea Phytochemistry 2018 154 10-18. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2018.06.010 | PMID | 29929021 |
