Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA009119
PROPERTIES
NPAID | NPA009119 |
---|---|
CLUSTER ID | 1345 |
NODE ID | 52 |
NAME | 7alpha-Hydroxybotryenalol |
FORMULA | C17H26O5 |
MOLECULAR WEIGHT (Da) | 310.3900 |
ACCURATE MASS (Da) | 310.1780 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Daldinia |
ORIGIN SPECIES | concentrica |
InChIKey | LCAFIAWKWPMFHH-RTNSRKOKSA-N |
InChI | InChI=1S/C17H26O5/c1-9-6-12(22-10(2)20)14-13(11(9)7-18)17(5,8-19)15(21)16(14,3)4/h7,9,12,14-15,19,21H,6,8H2,1-5H3/t9-,12+,14-,15-,17-/m1/s1 |
SMILES | C[C@@H]1C[C@@H]([C@@H]2C(=C1C=O)[C@@]([C@@H](C2(C)C)O)(C)CO)OC(=O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Qin, Xiang-Dong; Shao, Hong-Jun; Dong, Ze-Jun; Liu, Ji-Kai Six New Induced Sesquiterpenes from the Cultures of Ascomycete Daldinia concentrica Journal of Antibiotics 2008 61 (9) 556-562. | ||
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DOI | 10.1038/ja.2008.74 | PMID | 19160523 |