Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA010591
PROPERTIES
NPAID | NPA010591 |
---|---|
CLUSTER ID | 796 |
NODE ID | 690 |
NAME | Speciosin A |
FORMULA | C10H8O3 |
MOLECULAR WEIGHT (Da) | 176.1710 |
ACCURATE MASS (Da) | 176.0473 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Hexagonia |
ORIGIN SPECIES | speciosa |
InChIKey | AXIMRAFIBNWUDM-SFGNSQDASA-N |
InChI | InChI=1S/C10H8O3/c1-2-3-6-10-8(12)5-4-7(11)9(10)13-10/h2,4-5,7,9,11H,1H2/t7-,9+,10-/m0/s1 |
SMILES | C=CC#C[C@]12[C@H](O1)[C@H](C=CC2=O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Jiang, Meng-Yuan; Zhang, Ling; Liu, Rong; Dong, Ze-Jun; Liu, Ji-Kai Speciosins A-K, oxygenated cyclohexanoids from the basidiomycete Hexagonia speciosa Journal of Natural Products 2009 72 (8) 1405-1409. | ||
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DOI | 10.1021/np900182m | PMID | 19624146 |