Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004580
PROPERTIES
| NPAID | NPA004580 |
|---|---|
| CLUSTER ID | 2367 |
| NODE ID | 1864 |
| NAME | Oxacyclododecindione |
| FORMULA | C18H21ClO6 |
| MOLECULAR WEIGHT (Da) | 368.8130 |
| ACCURATE MASS (Da) | 368.1027 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Exserohilum |
| ORIGIN SPECIES | rostratum |
| InChIKey | CKSXTSLBLCBNFG-UITAMQMPSA-N |
| InChI | InChI=1S/C18H21ClO6/c1-9-5-4-6-18(3,24)10(2)25-14(22)7-11-15(17(9)23)12(20)8-13(21)16(11)19/h5,8,10,20-21,24H,4,6-7H2,1-3H3/b9-5- |
| SMILES | CC1C(CC/C=C(\C(=O)C2=C(CC(=O)O1)C(=C(C=C2O)O)Cl)/C)(C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Erkel, Gerhard; Belahmer, Hanane; Serwe, Annegret; Anke, Timm; Kunz, Horst; Kolshorn, Heinz; Liermann, Johannes; Opatz, Till Oxacyclododecindione, a novel inhibitor of IL-4 signaling from Exserohilum rostratum Journal of Antibiotics 2008 61 (5) 285-290. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2008.40 | PMID | 18653993 |
