Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010942
PROPERTIES
| NPAID | NPA010942 |
|---|---|
| CLUSTER ID | 4295 |
| NODE ID | 3166 |
| NAME | Amicoumacin B |
| FORMULA | C20H30N2O9 |
| MOLECULAR WEIGHT (Da) | 442.4650 |
| ACCURATE MASS (Da) | 442.1951 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Bacillus |
| ORIGIN SPECIES | pumilus BN-103 |
| InChIKey | ZVMJOYORHWNPCZ-MLXNOORUSA-N |
| InChI | InChI=1S/C20H30N2O9/c1-9(2)6-12(22-19(29)18(28)17(27)11(21)8-15(25)26)14(24)7-10-4-3-5-13(23)16(10)20(30)31/h3-5,9,11-12,14,17-18,23-24,27-28H,6-8,21H2,1-2H3,(H,22,29)(H,25,26)(H,30,31)/t11?,12-,14?,17?,18-/m0/s1 |
| SMILES | CC(C)C[C@@H](C(CC1=C(C(=CC=C1)O)C(=O)O)O)NC(=O)[C@H](C(C(CC(=O)O)N)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Itoh, Jiro; Omoto, Shoji; Nishizawa, Nobusuke; Kodama, Yoshio; Inouye, Shigeharu Chemical Structures of Amicoumacins Produced by Bacillus pumilus Agricultural and Biological Chemistry 1982 46 (11) 2659-2665. | ||
|---|---|---|---|
| DOI | 10.1080/00021369.1982.10865491 | PMID | - |
