Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005724281 | Gold | 3 |
| CCMSLIB00005724287 | Gold | 3 |
COMPOUND NPA006162
PROPERTIES
| NPAID | NPA006162 |
|---|---|
| CLUSTER ID | 994 |
| NODE ID | 856 |
| NAME | 14,20-Dideoxy-thaxtomin A |
| FORMULA | C22H22N4O4 |
| MOLECULAR WEIGHT (Da) | 406.4420 |
| ACCURATE MASS (Da) | 406.1641 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | scabies |
| InChIKey | GJJXGBLNXDIHIQ-GGYWPGCISA-N |
| InChI | InChI=1S/C22H22N4O4/c1-24-18(11-14-7-4-3-5-8-14)21(27)25(2)19(22(24)28)12-15-13-23-16-9-6-10-17(20(15)16)26(29)30/h3-10,13,18-19,23H,11-12H2,1-2H3/t18?,19-/m0/s1 |
| SMILES | CN1[C@H](C(=O)N(C(C1=O)CC2=CC=CC=C2)C)CC3=CNC4=C3C(=CC=C4)[N+](=O)[O-] |
ORIGINAL ISOLATION REFERENCE
| CITATION | King, Russell R; Lawrence, C Harold; Calhoun, Larry A Chemistry of phytotoxins associated with Streptomyces scabies the causal organism of potato common scab Journal of Agricultural and Food Chemistry 1992 40 (5) 834-837. | ||
|---|---|---|---|
| DOI | 10.1021/jf00017a025 | PMID | - |
