Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000001623 | Gold | 1!CCMSLIB00000001624 |
COMPOUND NPA013913
PROPERTIES
| NPAID | NPA013913 |
|---|---|
| CLUSTER ID | 4644 |
| NODE ID | 3379 |
| NAME | Marineosin A |
| FORMULA | C25H35N3O2 |
| MOLECULAR WEIGHT (Da) | 409.5740 |
| ACCURATE MASS (Da) | 409.2729 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | JPTGQNMDWMSVSF-DUENCVSESA-N |
| InChI | InChI=1S/C25H35N3O2/c1-17-15-18-9-6-4-3-5-7-10-19-12-13-21(27-19)24(18)25(30-17)23(29-2)16-22(28-25)20-11-8-14-26-20/h8,11-14,17-18,23-24,26-27H,3-7,9-10,15-16H2,1-2H3/t17-,18-,23+,24-,25-/m0/s1 |
| SMILES | C[C@H]1C[C@@H]2CCCCCCCC3=CC=C([C@H]2[C@@]4(O1)[C@@H](CC(=N4)C5=CC=CN5)OC)N3 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Boonlarppradab, Chollaratt; Kauffman, Christopher A; Jensen, Paul R; Fenical, William Marineosins A and B, cytotoxic spiroaminals from a marine-derived actinomycete Organic Letters 2008 10 (24) 5505-5508. | ||
|---|---|---|---|
| DOI | 10.1021/ol8020644 | PMID | 19007176 |
