Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00004751263 | Gold | 3 |
COMPOUND NPA016668
PROPERTIES
| NPAID | NPA016668 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | Tumidulin |
| FORMULA | C17H14Cl2O7 |
| MOLECULAR WEIGHT (Da) | 401.1980 |
| ACCURATE MASS (Da) | 400.0117 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Ramalina |
| ORIGIN SPECIES | tumidula |
| InChIKey | CSRJYVIKHJFLSA-UHFFFAOYSA-N |
| InChI | InChI=1S/C17H14Cl2O7/c1-6-4-8(5-9(20)10(6)16(23)25-3)26-17(24)11-7(2)12(18)15(22)13(19)14(11)21/h4-5,20-22H,1-3H3 |
| SMILES | CC1=CC(=CC(=C1C(=O)OC)O)OC(=O)C2=C(C(=C(C(=C2O)Cl)O)Cl)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Huneck, Siegfried Flechteninhaltsstoffe, XXIV. Die Struktur von Tumidulin, einem neuen chlorhaltigen Depsid Chemische Berichte 1966 99 (4) 1106-1110. | ||
|---|---|---|---|
| DOI | 10.1002/cber.19660990404 | PMID | - |
