Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011913
PROPERTIES
| NPAID | NPA011913 |
|---|---|
| CLUSTER ID | 394 |
| NODE ID | 11 |
| NAME | Tryptoquivaline K |
| FORMULA | C25H20N4O5 |
| MOLECULAR WEIGHT (Da) | 456.4580 |
| ACCURATE MASS (Da) | 456.1434 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | sp. |
| InChIKey | XCCSYLWRYYKLSU-OPJGWUQDSA-N |
| InChI | InChI=1S/C25H20N4O5/c1-14(30)29-22-25(16-7-3-5-9-18(16)28(22)23(33)24(29)10-11-24)12-19(21(32)34-25)27-13-26-17-8-4-2-6-15(17)20(27)31/h2-9,13,19,22H,10-12H2,1H3/t19-,22-,25-/m1/s1 |
| SMILES | CC(=O)N1[C@@H]2[C@@]3(C[C@H](C(=O)O3)N4C=NC5=CC=CC=C5C4=O)C6=CC=CC=C6N2C(=O)C17CC7 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhou, Yaming; Debbab, Abdessamad; Mándi, Attila; Wray, Victor; Schulz, Barbara; Müller, Werner E. G.; Kassack, Matthias; Lin, WenHan; Kurtán, Tibor; Proksch, Peter; Aly, Amal H. Alkaloids from the Sponge-Associated Fungus Aspergillus sp European Journal of Organic Chemistry 2013 2013 (5) 894-906. | ||
|---|---|---|---|
| DOI | 10.1002/ejoc.201201220 | PMID | - |
