Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006181
PROPERTIES
| NPAID | NPA006181 |
|---|---|
| CLUSTER ID | 2540 |
| NODE ID | 542 |
| NAME | Herqueiazole |
| FORMULA | C22H21NO5 |
| MOLECULAR WEIGHT (Da) | 379.4120 |
| ACCURATE MASS (Da) | 379.1420 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | sp. |
| InChIKey | IXKZXMJHICVGBA-MLMJSJRWSA-N |
| InChI | InChI=1S/C22H21NO5/c1-8-6-12(24)14-11-7-9(2)23-17(11)18(25)16-15(14)13(8)20-22(27,19(16)26)21(4,5)10(3)28-20/h6-7,10,23-24,27H,1-5H3/t10-,22+/m0/s1 |
| SMILES | C[C@H]1C([C@@]2(C(=C3C(=CC(=C4C3=C(C2=O)C(=O)C5=C4C=C(N5)C)O)C)O1)O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Julianti, Elin; Lee, Jung-Ho; Liao, Lijuan; Park, Wanki; Park, Sunghyouk; Oh, Dong-Chan; Oh, Ki-Bong; Shin, Jongheon New polyaromatic metabolites from a marine-derived fungus Penicillium sp Organic Letters 2013 15 (6) 1286-1289. | ||
|---|---|---|---|
| DOI | 10.1021/ol4002174 | PMID | 23431962 |
