Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014011
PROPERTIES
| NPAID | NPA014011 |
|---|---|
| CLUSTER ID | 1105 |
| NODE ID | 582 |
| NAME | 9-deoxyhymatoxin A |
| FORMULA | C20H30O6S |
| MOLECULAR WEIGHT (Da) | 398.5210 |
| ACCURATE MASS (Da) | 398.1763 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Xylaria |
| ORIGIN SPECIES | sp. YM 311647 |
| InChIKey | ZRFMKYKOLFQQPF-QWFGBESBSA-N |
| InChI | InChI=1S/C20H30O6S/c1-18(9-10-25-27(22,23)24)8-5-14-13(12-18)11-15-16-19(14,2)6-4-7-20(16,3)17(21)26-15/h11,14-16H,4-10,12H2,1-3H3,(H,22,23,24)/t14-,15+,16+,18+,19+,20-/m0/s1 |
| SMILES | C[C@@]1(CC[C@H]2C(=C[C@@H]3[C@@H]4[C@@]2(CCC[C@@]4(C(=O)O3)C)C)C1)CCOS(=O)(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wu, Shao-Hua; He, Jian; Li, Xiao-Nian; Huang, Rong; Song, Fei; Chen, You-Wei; Miao, Cui-Ping Guaiane sesquiterpenes and isopimarane diterpenes from an endophytic fungus Xylaria sp Phytochemistry 2014 105 197-204. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2014.04.016 | PMID | 24890390 |
