Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA030218
PROPERTIES
| NPAID | NPA030218 |
|---|---|
| CLUSTER ID | 8860 |
| NODE ID | 5975 |
| NAME | Iqalisetin B |
| FORMULA | C17H21NO5 |
| MOLECULAR WEIGHT (Da) | 319.3570 |
| ACCURATE MASS (Da) | 319.1420 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Tolypocladium |
| ORIGIN SPECIES | sp. |
| InChIKey | QESOYLZLBJPMRG-CPZDRMBDSA-N |
| InChI | InChI=1S/C17H21NO5/c1-7-3-4-9-5-11(19)12(20)6-10(9)13(7)16(22)14-15(21)8(2)18-17(14)23/h3-4,7-10,12-13,20,22H,5-6H2,1-2H3,(H,18,23)/b16-14-/t7-,8+,9-,10-,12+,13-/m1/s1 |
| SMILES | C[C@@H]1NC(=O)/C(=C(\O)[C@@H]2[C@H](C)C=C[C@@H]3CC(=O)[C@@H](O)C[C@H]32)C1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Grunwald A; Berrué F; Overy D; Kerr R Isolation of iqalisetins A and B from a Tolypocladium sp. isolated from marine sediment from Frobisher Bay in Canada’s arctic Canadian Journal of Chemistry 2016 94 (4) 444-448. | ||
|---|---|---|---|
| DOI | 10.1139/cjc-2015-0439 | PMID | - |
