Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001650
PROPERTIES
| NPAID | NPA001650 |
|---|---|
| CLUSTER ID | 1061 |
| NODE ID | 913 |
| NAME | Xylaric acid B |
| FORMULA | C16H26O7 |
| MOLECULAR WEIGHT (Da) | 330.3770 |
| ACCURATE MASS (Da) | 330.1679 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Xylaria |
| ORIGIN SPECIES | sp. 638 |
| InChIKey | XQFNJUGBCKSQRI-WDZSVEBTSA-N |
| InChI | InChI=1S/C16H26O7/c1-9(2)11-4-5-16(22,8-23-3)13(15(20)21)12(11)6-10(7-17)14(18)19/h6,9,11-13,17,22H,4-5,7-8H2,1-3H3,(H,18,19)(H,20,21)/b10-6+/t11-,12-,13-,16-/m1/s1 |
| SMILES | CC(C)[C@H]1CC[C@]([C@H]([C@@H]1/C=C(\CO)/C(=O)O)C(=O)O)(COC)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yan, Sha; Li, Saifei; Wu, Wen; Zhao, Feng; Bao, Li; Ding, Rong; Gao, Hao; Wen, Hua-An; Song, Fuhang; Liu, Hong-Wei Terpenoid and Phenolic Metabolites from the Fungus Xylaria sp. Associated with Termite Nests Chemistry and Biodiversity 2011 8 (9) 1689-1700. | ||
|---|---|---|---|
| DOI | 10.1002/cbdv.201100026 | PMID | 21922657 |
