Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000075071 | Silver | Stenothricin&D |
| CCMSLIB00000577839 | Gold | 3 |
| CCMSLIB00012160986 | Gold | 4 |
| CCMSLIB00010000783 | Gold | 4 |
COMPOUND NPA007735
PROPERTIES
| NPAID | NPA007735 |
|---|---|
| CLUSTER ID | 3421 |
| NODE ID | 141 |
| NAME | Stenothricin D |
| FORMULA | C49H85N11O17S |
| MOLECULAR WEIGHT (Da) | 1132.3460 |
| ACCURATE MASS (Da) | 1131.5846 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | roseosporus |
| InChIKey | PHDNRQWSNXDWOT-NSXDZLSWSA-N |
| InChI | InChI=1S/C49H85N11O17S/c1-8-29(5)18-14-12-10-11-13-15-19-31(63)22-38(64)52-37(27-78(74,75)76)46(70)59-41-30(6)77-39(65)24-60(7)49(73)33(20-16-17-21-50)54-44(68)35(25-61)56-47(71)40(28(3)4)58-42(66)32(9-2)53-43(67)34(23-51)55-45(69)36(26-62)57-48(41)72/h9,28-30,33-37,40-41,61-62H,8,10-27,50-51H2,1-7H3,(H,52,64)(H,53,67)(H,54,68)(H,55,69)(H,56,71)(H,57,72)(H,58,66)(H,59,70)(H,74,75,76)/b32-9-/t29?,30-,33+,34+,35+,36+,37+,40+,41+/m1/s1 |
| SMILES | CCC(C)CCCCCCCCC(=O)CC(=O)N[C@@H](CS(=O)(=O)O)C(=O)N[C@H]1[C@H](OC(=O)CN(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)/C(=C/C)/NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CO)CN)C(C)C)CO)CCCCN)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Liu WT; Lamsa A; Wong WR; Boudreau PD; Kersten R; Peng Y; Moree WJ; Duggan BM; Moore BS; Gerwick WH; Linington RG; Pogliano K; Dorrestein PC MS/MS-based networking and peptidogenomics guided genome mining revealed the stenothricin gene cluster in Streptomyces roseosporus Journal of Antibiotics 2014 67 (1) 99-104. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2013.99 | PMID | 24149839 |
