Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010937
PROPERTIES
| NPAID | NPA010937 |
|---|---|
| CLUSTER ID | 11 |
| NODE ID | 11 |
| NAME | 2,5‐dihydroxy‐8‐methoxy‐6‐methyl‐9‐oxo‐9H‐xanthene ‐1‐carboxylic acid |
| FORMULA | C16H12O7 |
| MOLECULAR WEIGHT (Da) | 316.2650 |
| ACCURATE MASS (Da) | 316.0583 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Xylaria |
| ORIGIN SPECIES | sp. FRR 5657 |
| InChIKey | WNNZOICLHAOLHA-UHFFFAOYSA-N |
| InChI | InChI=1S/C16H12O7/c1-6-5-9(22-2)12-14(19)11-8(23-15(12)13(6)18)4-3-7(17)10(11)16(20)21/h3-5,17-18H,1-2H3,(H,20,21) |
| SMILES | CC1=CC(=C2C(=C1O)OC3=C(C2=O)C(=C(C=C3)O)C(=O)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Davis, Rohan A.; Pierens, Gregory K. 1H and13C NMR assignments for two new xanthones from the endophytic fungusXylaria sp. FRR 5657 Magnetic Resonance in Chemistry 2006 44 (10) 966-968. | ||
|---|---|---|---|
| DOI | 10.1002/mrc.1872 | PMID | 16826555 |
