Compounds
COMPOUND NPA020090
PROPERTIES
| NPAID | NPA020090 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 45 |
| NAME | Emodin |
| FORMULA | C15H10O5 |
| MOLECULAR WEIGHT (Da) | 270.2400 |
| ACCURATE MASS (Da) | 270.0528 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | wentii |
| InChIKey | RHMXXJGYXNZAPX-UHFFFAOYSA-N |
| InChI | InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3 |
| SMILES | CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wells, JM; Cole, RJ; Kirksey, JW Emodin, a toxic metabolite of Aspergillus wentii isolated from weevil-damaged chestnuts Applied Microbiology 1975 30 (1) 26-28. | ||
|---|---|---|---|
| DOI | 10.5281/zenodo.3541164 | PMID | 1147616 |
