Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022195
PROPERTIES
| NPAID | NPA022195 |
|---|---|
| CLUSTER ID | 6841 |
| NODE ID | 4728 |
| NAME | 4'-demethoxy-4'-N-isopentylisogriseofulvin |
| FORMULA | C21H26ClNO5 |
| MOLECULAR WEIGHT (Da) | 407.8940 |
| ACCURATE MASS (Da) | 407.1500 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | griseofulvum CPCC 400528 |
| InChIKey | FWXSSMAVADBBBU-GTJPDFRWSA-N |
| InChI | InChI=1S/C21H26ClNO5/c1-11(2)6-7-23-13-8-12(3)21(16(24)9-13)20(25)17-14(26-4)10-15(27-5)18(22)19(17)28-21/h9-12,23H,6-8H2,1-5H3/t12-,21+/m1/s1 |
| SMILES | C[C@@H]1CC(=CC(=O)[C@]12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)NCCC(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Dewu; Zhao, Lili; Wang, Lining; Fang, Xiaomei; Zhao, Jianyuan; Wang, Xinwei; Li, Li; Liu, Hongyu; Wei, Yuzhen; You, Xuefu; Cen, Shan; Yu, Liyan Griseofulvin Derivative and Indole Alkaloids from Penicillium griseofulvum CPCC 400528 Journal of Natural Products 2017 80 (2) 371-376. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.6b00829 | PMID | 28117586 |
