Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022197
PROPERTIES
| NPAID | NPA022197 |
|---|---|
| CLUSTER ID | 1059 |
| NODE ID | 911 |
| NAME | 2-demethylsperadine F |
| FORMULA | C20H20N2O7 |
| MOLECULAR WEIGHT (Da) | 400.3870 |
| ACCURATE MASS (Da) | 400.1271 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | griseofulvum CPCC 400528 |
| InChIKey | XQCRMAWEEAMNOR-SMITWXTISA-N |
| InChI | InChI=1S/C20H20N2O7/c1-8(23)18(26)15(25)22-16(2,3)10-7-9-5-4-6-11-12(9)17(14(24)21-11)13(10)19(22,27)20(18,28)29-17/h4-6,10,13,26-28H,7H2,1-3H3,(H,21,24)/t10-,13-,17+,18-,19+,20-/m1/s1 |
| SMILES | CC(=O)[C@]1(C(=O)N2[C@]3([C@@]1(O[C@]45[C@H]3[C@H](C2(C)C)CC6=C4C(=CC=C6)NC5=O)O)O)O |
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 |
