Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015179
PROPERTIES
| NPAID | NPA015179 |
|---|---|
| CLUSTER ID | 5324 |
| NODE ID | 3793 |
| NAME | Pantocin A |
| FORMULA | C14H17N3O5 |
| MOLECULAR WEIGHT (Da) | 307.3060 |
| ACCURATE MASS (Da) | 307.1168 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Pantoea |
| ORIGIN SPECIES | agglomerans Eh318 |
| InChIKey | SOPAHPGXYDUTGN-QMFGVRBNSA-N |
| InChI | InChI=1S/C14H17N3O5/c15-8-4-2-6-1-3-7(11(6)12(8)19)13(20)17-9(14(21)22)5-10(16)18/h1-3,7-9,11H,4-5,15H2,(H2,16,18)(H,17,20)(H,21,22)/t7?,8-,9-,11?/m0/s1 |
| SMILES | C1C=C2C=CC(C2C(=O)[C@H]1N)C(=O)N[C@@H](CC(=O)N)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Jin, Mi; Liu, Liang; Wright, Sandra A I; Beer, Steven V; Clardy, Jon Structural and functional analysis of pantocin A: an antibiotic from Pantoea agglomerans discovered by heterologous expression of cloned genes Angewandte Chemie International Edition 2003 42 (25) 2898-2901. | ||
|---|---|---|---|
| DOI | 10.1002/anie.200351053 | PMID | 12833353 |
