Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014462
PROPERTIES
| NPAID | NPA014462 |
|---|---|
| CLUSTER ID | 3013 |
| NODE ID | 2306 |
| NAME | Aurachin P |
| FORMULA | C25H33NO4 |
| MOLECULAR WEIGHT (Da) | 411.5420 |
| ACCURATE MASS (Da) | 411.2410 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Stigmatella |
| ORIGIN SPECIES | erecta strain Pd e32 |
| InChIKey | MIQSPYRWRFLNMZ-KMRJWCEASA-N |
| InChI | InChI=1S/C25H33NO4/c1-16(2)10-8-11-17(3)12-9-15-25(5,28)24-22(27)21-19-13-6-7-14-20(19)26(29)18(4)23(21)30-24/h6-7,10,12-14,22,24,27-28H,8-9,11,15H2,1-5H3/b17-12+/t22-,24+,25-/m0/s1 |
| SMILES | [H][C@]1(OC2=C([C@@H]1O)C1=CC=CC=C1N(=O)=C2C)[C@@](C)(O)CC\C=C(/C)CCC=C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hoefle, Gerhard; Irschik, Herbert Isolation and biosynthesis of aurachin P and 5-nitroresorcinol from Stigmatella erecta Journal of Natural Products 2008 71 (11) 1946-1948. | ||
|---|---|---|---|
| DOI | 10.1021/np800325z | PMID | 18986196 |
