Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028603
PROPERTIES
| NPAID | NPA028603 |
|---|---|
| CLUSTER ID | 8549 |
| NODE ID | 5789 |
| NAME | Konbamide |
| FORMULA | C40H61BrN8O9 |
| MOLECULAR WEIGHT (Da) | 877.8790 |
| ACCURATE MASS (Da) | 876.3745 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Entotheonella |
| ORIGIN SPECIES | factor |
| InChIKey | NFNPOETXDOOFIQ-CIMYTASASA-N |
| InChI | InChI=1S/C40H61BrN8O9/c1-20(2)15-30-38(55)49(8)32(17-22(5)6)37(54)45-29(19-26-25-18-24(50)12-13-27(25)44-33(26)41)35(52)42-14-10-9-11-28(36(53)43-23(7)34(51)46-30)47-40(58)48-31(39(56)57)16-21(3)4/h12-13,18,20-23,28-32,44,50H,9-11,14-17,19H2,1-8H3,(H,42,52)(H,43,53)(H,45,54)(H,46,51)(H,56,57)(H2,47,48,58)/t23-,28-,29?,30-,31-,32-/m0/s1 |
| SMILES | CC(C)C[C@H](NC(=O)N[C@H]1CCCCNC(=O)C(CC2=C(Br)[NH]C3=C2C=C(O)C=C3)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC1=O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wilson MC; Mori T; Rückert C; Uria AR; Helf MJ; Takada K; Gernert C; Steffens UA; Heycke N; Schmitt S; Rinke C; Helfrich EJ; Brachmann AO; Gurgui C; Wakimoto T; Kracht M; Crüsemann M; Hentschel U; Abe I; Matsunaga S; Kalinowski J; Takeyama H; Piel J An environmental bacterial taxon with a large and distinct metabolic repertoire. Nature 2014 506 (7486) 58-62. | ||
|---|---|---|---|
| DOI | 10.1038/nature12959 | PMID | 24476823 |
