Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012181
PROPERTIES
| NPAID | NPA012181 |
|---|---|
| CLUSTER ID | 4610 |
| NODE ID | 3362 |
| NAME | Pulcherriminic acid |
| FORMULA | C12H20N2O4 |
| MOLECULAR WEIGHT (Da) | 256.3020 |
| ACCURATE MASS (Da) | 256.1423 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Candida |
| ORIGIN SPECIES | pulcherrima |
| InChIKey | WXWWNANFOZVVLD-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H20N2O4/c1-7(2)5-9-11(15)14(18)10(6-8(3)4)12(16)13(9)17/h7-8,15-16H,5-6H2,1-4H3 |
| SMILES | CC(C)CC1=C(O)N(=O)=C(CC(C)C)C(O)=N1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | MacDonald, JC The structure of pulcherriminic acid Canadian Journal of Chemistry 1963 41 (1) 165-172. | ||
|---|---|---|---|
| DOI | 10.1139/v63-021 | PMID | - |
