Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00004751459 | Gold | 3!CCMSLIB00004751374 |
| CCMSLIB00005719722 | Gold | 3 |
| CCMSLIB00005719723 | Gold | 3 |
| CCMSLIB00005719067 | Gold | 3 |
| CCMSLIB00005720067 | Gold | 3 |
| CCMSLIB00005719721 | Gold | 3 |
COMPOUND NPA020086
PROPERTIES
| NPAID | NPA020086 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | w-hydroxyemodin |
| FORMULA | C15H10O6 |
| MOLECULAR WEIGHT (Da) | 286.2390 |
| ACCURATE MASS (Da) | 286.0477 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | cyclopium |
| InChIKey | YQHZABGPIPECSQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C15H10O6/c16-5-6-1-8-12(10(18)2-6)15(21)13-9(14(8)20)3-7(17)4-11(13)19/h1-4,16-19H,5H2 |
| SMILES | C1=C(C=C2C(=C1O)C(=O)C3=C(C=C(C=C3C2=O)O)O)CO |
ORIGINAL ISOLATION REFERENCE
| CITATION | Anslow, WK; Breen, J; Raistrick, H Studies in the biochemistry of micro-organisms: 64 Emodic Acid and omega-Hydroxyemodin Biochemical Journal 1940 43 (2) 159-169. | ||
|---|---|---|---|
| DOI | 10.1042/bj0340159 | PMID | 16747151 |
