Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005727157 | Gold | 3 |
| CCMSLIB00005727065 | Gold | 3 |
| CCMSLIB00005727331 | Gold | 3 |
| CCMSLIB00005727271 | Gold | 3 |
| CCMSLIB00005727236 | Gold | 3 |
COMPOUND NPA032752
PROPERTIES
| NPAID | NPA032752 |
|---|---|
| CLUSTER ID | 9472 |
| NODE ID | 6341 |
| NAME | Tentoxin |
| FORMULA | C22H30N4O4 |
| MOLECULAR WEIGHT (Da) | 414.5060 |
| ACCURATE MASS (Da) | 414.2267 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Alternaria |
| ORIGIN SPECIES | tenuis |
| InChIKey | SIIRBDOFKDACOK-LFXZBHHUSA-N |
| InChI | InChI=1S/C22H30N4O4/c1-14(2)11-17-22(30)26(5)18(12-16-9-7-6-8-10-16)21(29)23-13-19(27)25(4)15(3)20(28)24-17/h6-10,12,14-15,17H,11,13H2,1-5H3,(H,23,29)(H,24,28)/b18-12-/t15-,17-/m0/s1 |
| SMILES | CC(C)C[C@@H]1NC(=O)[C@H](C)N(C)C(=O)CNC(=O)/C(=C/C2=CC=CC=C2)N(C)C1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Meyer, W. L.; Templeton, G. E.; Grable, C. I. The Structure of Tentoxin Tetrahedron Letters 1971 12 (25) 2357-2360. | ||
|---|---|---|---|
| DOI | 10.1016/S0040-4039(01)96862-5 | PMID | - |
