Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA007774
PROPERTIES
NPAID | NPA007774 |
---|---|
CLUSTER ID | 1345 |
NODE ID | 52 |
NAME | Botryenalol |
FORMULA | C17H26O4 |
MOLECULAR WEIGHT (Da) | 294.3910 |
ACCURATE MASS (Da) | 294.1831 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Botrytis |
ORIGIN SPECIES | cinerea |
InChIKey | DSVSTMJOGQEZJX-BYLNDYCFSA-N |
InChI | InChI=1S/C17H26O4/c1-10-6-13(21-11(2)20)15-14(12(10)7-18)17(5,9-19)8-16(15,3)4/h7,10,13,15,19H,6,8-9H2,1-5H3/t10-,13+,15-,17-/m1/s1 |
SMILES | C[C@@H]1C[C@@H]([C@@H]2C(=C1C=O)[C@@](CC2(C)C)(C)CO)OC(=O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Collado, Isidro G.; Hernández-Galán, Rosario; Prieto, Victoria; Hanson, James R.; Rebordinos, Laureana G. Biologically active sesquiterpenoid metabolites from the fungus Botrytis cinerea Phytochemistry 1996 41 (2) 513-517. | ||
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DOI | 10.1016/0031-9422(95)00643-5 | PMID | - |