Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000799
PROPERTIES
| NPAID | NPA000799 |
|---|---|
| CLUSTER ID | 570 |
| NODE ID | 509 |
| NAME | (-)-Dihydropertusaric acid |
| FORMULA | C20H34O5 |
| MOLECULAR WEIGHT (Da) | 354.4870 |
| ACCURATE MASS (Da) | 354.2406 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Pertusaria |
| ORIGIN SPECIES | albescens |
| InChIKey | GITAQGNGLWXMTE-BZSNNMDCSA-N |
| InChI | InChI=1S/C20H34O5/c1-15(21)13-11-9-7-5-3-4-6-8-10-12-14-17-18(19(22)23)16(2)20(24)25-17/h16-18H,3-14H2,1-2H3,(H,22,23)/t16-,17-,18-/m0/s1 |
| SMILES | C[C@H]1[C@@H]([C@@H](OC1=O)CCCCCCCCCCCCC(=O)C)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Huneck, Siegfried; Tønsberg, Tor; Bohlmann, Ferdinand (-)-Allo-pertusaric acid and (-)-dihydropertusaric acid from the lichen Pertusaria albescens Phytochemistry 1986 25 (2) 453-459. | ||
|---|---|---|---|
| DOI | 10.1016/s0031-9422(00)85500-4 | PMID | - |
