Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017992
PROPERTIES
| NPAID | NPA017992 |
|---|---|
| CLUSTER ID | 1416 |
| NODE ID | 28 |
| NAME | (1S,2S,4R,5R,7R,10R)-guaiane-2,4,10,11,12-pentaol |
| FORMULA | C15H28O5 |
| MOLECULAR WEIGHT (Da) | 288.3840 |
| ACCURATE MASS (Da) | 288.1937 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Xylaria |
| ORIGIN SPECIES | sp. YM 311647 |
| InChIKey | IXFRQVRAVLEFDG-KYHUKMSWSA-N |
| InChI | InChI=1S/C15H28O5/c1-13(18)5-4-9(15(3,20)8-16)6-10-12(13)11(17)7-14(10,2)19/h9-12,16-20H,4-8H2,1-3H3/t9-,10-,11+,12+,13-,14-,15?/m1/s1 |
| SMILES | C[C@]1(CC[C@H](C[C@@H]2[C@H]1[C@H](C[C@@]2(C)O)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 |
