Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA020245
PROPERTIES
| NPAID | NPA020245 |
|---|---|
| CLUSTER ID | 6442 |
| NODE ID | 4458 |
| NAME | Pseudellone C |
| FORMULA | C31H27N5O3 |
| MOLECULAR WEIGHT (Da) | 517.5890 |
| ACCURATE MASS (Da) | 517.2114 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Pseudallescheria |
| ORIGIN SPECIES | ellipsoidea F42-3 |
| InChIKey | YYJAIURBLXTPFP-MHZLTWQESA-N |
| InChI | InChI=1S/C31H27N5O3/c1-31(22-16-34-25-13-7-4-10-19(22)25,23-17-35-26-14-8-5-11-20(23)26)30(39)36-27(29(38)32-2)28(37)21-15-33-24-12-6-3-9-18(21)24/h3-17,27,33-35H,1-2H3,(H,32,38)(H,36,39)/t27-/m0/s1 |
| SMILES | CC(C1=CNC2=CC=CC=C21)(C3=CNC4=CC=CC=C43)C(=O)N[C@@H](C(=O)C5=CNC6=CC=CC=C65)C(=O)NC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Liu, Wei; Li, Hou-Jin; Xu, Meng-Yang; Ju, Ying-Chen; Wang, Lai-You; Xu, Jun; Yang, De-Po; Lan, Wen-Jian Pseudellones A-C, Three Alkaloids from the Marine-Derived Fungus Pseudallescheria ellipsoidea F42-3 Organic Letters 2015 17 (21) 5156-5159. | ||
|---|---|---|---|
| DOI | 10.1021/acs.orglett.5b02311 | PMID | 26452138 |
