Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024809
PROPERTIES
| NPAID | NPA024809 |
|---|---|
| CLUSTER ID | 3262 |
| NODE ID | 2481 |
| NAME | Burkholdac A |
| FORMULA | C22H35N3O6S3 |
| MOLECULAR WEIGHT (Da) | 533.7380 |
| ACCURATE MASS (Da) | 533.1688 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Burkholderia |
| ORIGIN SPECIES | thailandensis |
| InChIKey | ZRJPMGCEOCZSQC-GQCTYLIASA-N |
| InChI | InChI=1S/C22H35N3O6S3/c1-13(2)20-17(26)11-19(28)31-14-6-4-5-8-33-34-12-16(22(30)25-20)24-21(29)15(7-9-32-3)23-18(27)10-14/h4,6,13-17,20,26H,5,7-12H2,1-3H3,(H,23,27)(H,24,29)(H,25,30)/b6-4+ |
| SMILES | CC(C)C1C(CC(=O)OC\2CC(=O)NC(C(=O)NC(CSSCC/C=C2)C(=O)N1)CCSC)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Biggins JB; Gleber CD; Brady SF Acyldepsipeptide HDAC inhibitor production induced in Burkholderia thailandensis. Organic Letters 2011 13 (6) 1536-1539. | ||
|---|---|---|---|
| DOI | 10.1021/ol200225v | PMID | 21348454 |
