Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA032827
PROPERTIES
| NPAID | NPA032827 |
|---|---|
| CLUSTER ID | 9485 |
| NODE ID | 6348 |
| NAME | Acidobactin B |
| FORMULA | C28H47N7O15 |
| MOLECULAR WEIGHT (Da) | 721.7180 |
| ACCURATE MASS (Da) | 721.3130 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Acidovorax |
| ORIGIN SPECIES | citrulli AAC00-1 |
| InChIKey | WIQQJJJLRHWSIE-UHFFFAOYSA-N |
| InChI | InChI=1S/C28H47N7O15/c1-13-9-19(40)30-15(6-4-8-35(49)12-37)18(39)10-20(41)33-21(14(2)38)26(45)31-16(5-3-7-29)24(43)32-17(11-36)25(44)34-22(28(48)50-13)23(42)27(46)47/h12-18,21-23,36,38-39,42,49H,3-11,29H2,1-2H3,(H,30,40)(H,31,45)(H,32,43)(H,33,41)(H,34,44)(H,46,47) |
| SMILES | CC1CC(=O)NC(CCCN(O)C=O)C(O)CC(=O)NC(C(C)O)C(=O)NC(CCCN)C(=O)NC(CO)C(=O)NC(C(O)C(=O)O)C(=O)O1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Johnston, Chad W.; Skinnider, Michael A.; Wyatt, Morgan A.; Li, Xiang; Ranieri, Michael R. M.; Yang, Lian; Zechel, David L.; Ma, Bin; Magarvey, Nathan A. An automated Genomes-to-Natural Products platform (GNP) for the discovery of modular natural products Nature Communications 2015 6 (None) None. | ||
|---|---|---|---|
| DOI | 10.1038/ncomms9421 | PMID | 26412281 |
