Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA018835
PROPERTIES
NPAID | NPA018835 |
---|---|
CLUSTER ID | 338 |
NODE ID | 306 |
NAME | (E)-nodulisporacid A |
FORMULA | C16H20O6 |
MOLECULAR WEIGHT (Da) | 308.3300 |
ACCURATE MASS (Da) | 308.1260 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Unknown-bacterium |
ORIGIN SPECIES | fungus CRI247-01 |
InChIKey | PJLKMFDHUJBABS-ZYWULKITSA-N |
InChI | InChI=1S/C16H20O6/c1-4-9(2)8-16(3)6-5-10(22-16)13-14(19)11(7-12(17)18)21-15(13)20/h5-6,9,11H,4,7-8H2,1-3H3,(H,17,18)/b13-10+/t9?,11-,16-/m1/s1 |
SMILES | CCC(C)C[C@]1(C=C/C(=C\2/C(=O)[C@H](OC2=O)CC(=O)O)/O1)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Kasettrathat, Chairut; Ngamrojanavanich, Nattaya; Wiyakrutta, Suthep; Mahidol, Chulabhorn; Ruchirawat, Somsak; Kittakoop, Prasat Cytotoxic and antiplasmodial substances from marine-derived fungi, Nodulisporium sp. and CRI247-01 Phytochemistry 2008 69 (14) 2621-2626. | ||
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DOI | 10.1016/j.phytochem.2008.08.005 | PMID | 18804825 |