Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000577604 | Gold | 3 |
COMPOUND NPA018994
PROPERTIES
| NPAID | NPA018994 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | [b-MePro] destruxin E chlorohydrin |
| FORMULA | C30H50ClN5O8 |
| MOLECULAR WEIGHT (Da) | 644.2100 |
| ACCURATE MASS (Da) | 643.3348 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Beauveria |
| ORIGIN SPECIES | felina |
| InChIKey | QWYNOTGFLNERCP-IRDIRMKXSA-N |
| InChI | InChI=1S/C30H50ClN5O8/c1-9-17(4)23-29(42)35(8)24(16(2)3)30(43)34(7)19(6)26(39)32-12-10-22(38)44-21(14-20(37)15-31)28(41)36-13-11-18(5)25(36)27(40)33-23/h16-21,23-25,37H,9-15H2,1-8H3,(H,32,39)(H,33,40)/t17?,18-,19-,20-,21?,23-,24-,25-/m0/s1 |
| SMILES | CCC(C)[C@H]1C(=O)N([C@H](C(=O)N([C@H](C(=O)NCCC(=O)OC(C(=O)N2CC[C@@H]([C@H]2C(=O)N1)C)C[C@@H](CCl)O)C)C)C(C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Lira, Simone P; Vita-Marques, Aline M; Seleghim, Mirna H R; Bugni, Tim S; LaBarbera, Daniel V; Sette, Lara D; Sponchiado, Sandra R P; Ireland, Chris M; Berlinck, Roberto G S New destruxins from the marine-derived fungus Beauveria felina Journal of Antibiotics 2006 59 (9) 553-563. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2006.76 | PMID | 17136888 |
