Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000577658 | Gold | 3 |
COMPOUND NPA014969
PROPERTIES
| NPAID | NPA014969 |
|---|---|
| CLUSTER ID | 2106 |
| NODE ID | 1684 |
| NAME | Kurstakin 4 |
| FORMULA | C41H67N11O12 |
| MOLECULAR WEIGHT (Da) | 906.0520 |
| ACCURATE MASS (Da) | 905.4971 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Bacillus |
| ORIGIN SPECIES | thuringiensis kurstaki HD-1 |
| InChIKey | HDSHTQMHVLVTSB-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H67N11O12/c1-23(2)12-10-8-6-5-7-9-11-13-33(56)52-35(25(4)53)40(62)46-21-34(57)47-24(3)36(58)51-29-22-64-41(63)27(15-17-31(43)55)49-37(59)26(14-16-30(42)54)48-38(60)28(50-39(29)61)20-32-44-18-19-45-32/h18-19,23-29,35,53H,5-17,20-22H2,1-4H3,(H2,42,54)(H2,43,55)(H,44,45)(H,46,62)(H,47,57)(H,48,60)(H,49,59)(H,50,61)(H,51,58)(H,52,56) |
| SMILES | CC(C)CCCCCCCCCC(=O)NC(C(C)O)C(=O)NCC(=O)NC(C)C(=O)NC1COC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CC2=NC=CN2)CCC(=O)N)CCC(=O)N |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hathout, Yetrib; Ho, Yen-Peng; Ryzhov, Victor; Demirev, Plamen; Fenselau, Catherine Kurstakins: A new class of lipopeptides isolated from Bacillus thuringiensis Journal of Natural Products 2000 63 (11) 1492-1496. | ||
|---|---|---|---|
| DOI | 10.1021/np000169q | PMID | 11087590 |
