Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010991
PROPERTIES
| NPAID | NPA010991 |
|---|---|
| CLUSTER ID | 4311 |
| NODE ID | 1253 |
| NAME | (-)-cereoaldomine |
| FORMULA | C16H15NO5 |
| MOLECULAR WEIGHT (Da) | 301.2980 |
| ACCURATE MASS (Da) | 301.0950 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Coniothyrium |
| ORIGIN SPECIES | cereale |
| InChIKey | LCSBVTRDUJHTLY-LURJTMIESA-N |
| InChI | InChI=1S/C16H15NO5/c1-6-16(2,3)11-14(21)12(17)10-9(15(11)22-6)7(5-18)4-8(19)13(10)20/h4-6,17,19-20H,1-3H3/t6-/m0/s1 |
| SMILES | C[C@H]1C(C2=C(O1)C3=C(C(=C(C=C3C=O)O)O)C(=N)C2=O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Elsebai, Mahmoud Fahmi; Natesan, Lavanya; Kehraus, Stefan; Mohamed, Ietidal E.; Schnakenburg, Gregor; Sasse, Florenz; Shaaban, Saad; Guetschow, Michael; Koenig, Gabriele M. HLE-inhibitory alkaloids with a polyketide skeleton from the marine-derived fungus Coniothyrium cereale Journal of Natural Products 2011 74 (10) 2282-2285. | ||
|---|---|---|---|
| DOI | 10.1021/np2004227 | PMID | 21923104 |
