Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013365
PROPERTIES
| NPAID | NPA013365 |
|---|---|
| CLUSTER ID | 643 |
| NODE ID | 571 |
| NAME | Hymenosetin |
| FORMULA | C23H33NO4 |
| MOLECULAR WEIGHT (Da) | 387.5200 |
| ACCURATE MASS (Da) | 387.2410 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Hymenoscyphus |
| ORIGIN SPECIES | pseudoalbidus |
| InChIKey | SAVBYHHROQZLEY-IONFRVELSA-N |
| InChI | InChI=1S/C23H33NO4/c1-6-7-16-13(3)11-15-10-12(2)8-9-17(15)23(16,5)21(27)18-20(26)19(14(4)25)24-22(18)28/h6-7,11-12,14-17,19,25,27H,8-10H2,1-5H3,(H,24,28)/b7-6+,21-18+/t12-,14-,15+,16-,17-,19+,23-/m1/s1 |
| SMILES | C/C=C/[C@@H]1C(=C[C@@H]2C[C@@H](CC[C@H]2[C@]1(C)/C(=C\3/C(=O)[C@@H](NC3=O)[C@@H](C)O)/O)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Halecker, Sandra; Surup, Frank; Kuhnert, Eric; Mohr, Kathrin I.; Brock, Nelson L.; Dickschat, Jeroen S.; Junker, Corina; Schulz, Barbara; Stadler, Marc Hymenosetin, a 3-decalinoyltetramic acid antibiotic from cultures of the ash dieback pathogen, Hymenoscyphus pseudoalbidus Phytochemistry 2014 100 86-91. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2014.01.018 | PMID | 24529574 |
SYNTHESES
| CITATION 1 | Kauhl U; Andernach L; Weck S; Sandjo LP; Jacob S; Thines E; Opatz T Total Synthesis of (-)-Hymenosetin. Journal of Organic Chemistry 2016 81 (1) 215-28. DOI: 10.1021/acs.joc.5b02526 PMID: 26636831 | ||
|---|---|---|---|
