Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00005435751 | Gold | 1 |
COMPOUND NPA027582
PROPERTIES
NPAID | NPA027582 |
---|---|
CLUSTER ID | 2398 |
NODE ID | 1886 |
NAME | Schizokinen |
FORMULA | C16H28N4O9 |
MOLECULAR WEIGHT (Da) | 420.4190 |
ACCURATE MASS (Da) | 420.1856 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Bacillus |
ORIGIN SPECIES | megaterium ATCC 19213 |
InChIKey | YILWWVUXGMGOAM-UHFFFAOYSA-N |
InChI | InChI=1S/C16H28N4O9/c1-11(21)19(28)7-3-5-17-13(23)9-16(27,15(25)26)10-14(24)18-6-4-8-20(29)12(2)22/h27-29H,3-10H2,1-2H3,(H,17,23)(H,18,24)(H,25,26) |
SMILES | CC(=O)N(O)CCCNC(=O)CC(O)(CC(=O)NCCCN(O)C(C)=O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Mullis KB; Pollack JR; Neilands JB Structure of schizokinen, an iron-transport compound from Bacillus megaterium. Biochemistry 1971 10 (26) 4894-4898. | ||
---|---|---|---|
DOI | 10.1021/bi00802a010 | PMID | 4332462 |