Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005114
PROPERTIES
| NPAID | NPA005114 |
|---|---|
| CLUSTER ID | 1416 |
| NODE ID | 28 |
| NAME | (1S,2S,4S,5S,7R,10R)-guaiane-2,10,11,12-tetraol |
| FORMULA | C15H28O4 |
| MOLECULAR WEIGHT (Da) | 272.3850 |
| ACCURATE MASS (Da) | 272.1988 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Xylaria |
| ORIGIN SPECIES | sp. YM 311647 |
| InChIKey | RDBZPQHLQRBYGV-CHLHFKEBSA-N |
| InChI | InChI=1S/C15H28O4/c1-9-6-12(17)13-11(9)7-10(15(3,19)8-16)4-5-14(13,2)18/h9-13,16-19H,4-8H2,1-3H3/t9-,10+,11-,12-,13-,14+,15?/m0/s1 |
| SMILES | C[C@H]1C[C@@H]([C@@H]2[C@H]1C[C@@H](CC[C@@]2(C)O)C(C)(CO)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Huang, Rong; Xie, Xiao-Song; Fang, Xiao-Wei; Ma, Kai-Xia; Wu, Shao-Hua Five new guaiane sesquiterpenes from the endophytic fungus Xylaria sp. YM 311647 of Azadirachta indica Chemistry and Biodiversity 2015 12 (8) 1281-1286. | ||
|---|---|---|---|
| DOI | 10.1002/cbdv.201400405 | PMID | 26265580 |
