Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028374
PROPERTIES
| NPAID | NPA028374 |
|---|---|
| CLUSTER ID | 34 |
| NODE ID | 33 |
| NAME | Dehydroxy-qinichelin |
| FORMULA | C31H49N9O13 |
| MOLECULAR WEIGHT (Da) | 755.7830 |
| ACCURATE MASS (Da) | 755.3450 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. MBT79 |
| InChIKey | IUFHNQWMTXPTDJ-PCPGVINSSA-N |
| InChI | InChI=1S/C31H49N9O13/c32-10-2-7-18(35-29(50)21(14-42)37-25(46)16-5-1-9-23(44)24(16)45)28(49)39-22(15-43)30(51)38-20(13-41)27(48)34-11-3-6-17(33)26(47)36-19-8-4-12-40(53)31(19)52/h1,5,9,17-22,41-45,53H,2-4,6-8,10-15,32-33H2,(H,34,48)(H,35,50)(H,36,47)(H,37,46)(H,38,51)(H,39,49)/t17-,18-,19-,20-,21+,22+/m0/s1 |
| SMILES | NCCC[C@H](NC(=O)[C@@H](CO)NC(=O)C1=C(O)C(O)=CC=C1)C(=O)N[C@H](CO)C(=O)N[C@@H](CO)C(=O)NCCC[C@H](N)C(=O)N[C@H]1CCCN(O)C1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Gubbens J; Wu C; Zhu H; Filippov DV; Florea BI; Rigali S; Overkleeft HS; van Wezel GP Intertwined Precursor Supply during Biosynthesis of the Catecholate-Hydroxamate Siderophores Qinichelins in Streptomyces sp. MBT76. ACS Chemical Biology 2017 12 (11) 2756-2766. | ||
|---|---|---|---|
| DOI | 10.1021/acschembio.7b00597 | PMID | 28945067 |
