Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005724276 | Gold | 3 |
COMPOUND NPA005473
PROPERTIES
| NPAID | NPA005473 |
|---|---|
| CLUSTER ID | 994 |
| NODE ID | 856 |
| NAME | P-hydroxyphenylthaxtomin A |
| FORMULA | C22H22N4O6 |
| MOLECULAR WEIGHT (Da) | 438.4400 |
| ACCURATE MASS (Da) | 438.1539 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | scabies |
| InChIKey | KDCUAPBLIKCUCK-PGRDOPGGSA-N |
| InChI | InChI=1S/C22H22N4O6/c1-24-18(10-14-12-23-16-4-3-5-17(19(14)16)26(31)32)20(28)25(2)22(30,21(24)29)11-13-6-8-15(27)9-7-13/h3-9,12,18,23,27,30H,10-11H2,1-2H3/t18-,22+/m0/s1 |
| SMILES | CN1[C@H](C(=O)N([C@](C1=O)(CC2=CC=C(C=C2)O)O)C)CC3=CNC4=C3C(=CC=C4)[N+](=O)[O-] |
ORIGINAL ISOLATION REFERENCE
| CITATION | King, Russell R.; Lawrence, C. Harold Characterization of New Thaxtomin A Analogues Generatedin VitrobyStreptomyces scabies Journal of Agricultural and Food Chemistry 1996 44 (4) 1108-1110. | ||
|---|---|---|---|
| DOI | 10.1021/jf950243o | PMID | - |
