Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA018366
PROPERTIES
NPAID | NPA018366 |
---|---|
CLUSTER ID | 2181 |
NODE ID | 1739 |
NAME | Sterebin Q2 |
FORMULA | C20H36O6 |
MOLECULAR WEIGHT (Da) | 372.5020 |
ACCURATE MASS (Da) | 372.2512 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Saccharomyces |
ORIGIN SPECIES | cerevisiae |
InChIKey | FWILCTKPZALIAU-NOLJLQBFSA-N |
InChI | InChI=1S/C20H36O6/c1-17(2)8-6-9-18(3)12(7-10-19(4,25)13(22)11-21)20(5,26)16(24)14(23)15(17)18/h7,10,12-16,21-26H,6,8-9,11H2,1-5H3/b10-7+/t12-,13+,14-,15+,16+,18-,19-,20+/m1/s1 |
SMILES | C[C@]12CCCC([C@@H]1[C@H]([C@@H]([C@@]([C@@H]2/C=C/[C@](C)([C@H](CO)O)O)(C)O)O)O)(C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Kamauchi, Hitoshi; Kon, Tatsuhiko; Kinoshita, Kaoru; Takatori, Kazuhiko; Takahashi, Kunio; Koyama, Kiyotaka New diterpenoids isolated from Stevia rebaudiana fermented by Saccharomyces cerevisiae Tetrahedron Letters 2015 56 (29) 4377-4382. | ||
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DOI | 10.1016/j.tetlet.2015.05.092 | PMID | - |