Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA000261
PROPERTIES
NPAID | NPA000261 |
---|---|
CLUSTER ID | 223 |
NODE ID | 209 |
NAME | Iso-cladospolide B |
FORMULA | C12H20O4 |
MOLECULAR WEIGHT (Da) | 228.2880 |
ACCURATE MASS (Da) | 228.1362 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Unknown-fungus |
ORIGIN SPECIES | isolate I96S215 |
InChIKey | XQIRBHFARGUNIX-DCAQKATOSA-N |
InChI | InChI=1S/C12H20O4/c1-9(13)5-3-2-4-6-10(14)11-7-8-12(15)16-11/h7-11,13-14H,2-6H2,1H3/t9-,10-,11-/m0/s1 |
SMILES | C[C@@H](CCCCC[C@@H]([C@@H]1C=CC(=O)O1)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Smith, C J; Abbanat, D; Bernan, V S; Maiese, W M; Greenstein, M; Jompa, J; Tahir, A; Ireland, C M Novel polyketide metabolites from a species of marine fungi Journal of Natural Products 2000 63 (1) 142-145. | ||
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DOI | 10.1021/np990361w | PMID | 10650098 |