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. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2008.74 | PMID | 19160523 |
