Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA023843
PROPERTIES
| NPAID | NPA023843 |
|---|---|
| CLUSTER ID | 556 |
| NODE ID | 114 |
| NAME | 4-epi-microsphaeropsisin |
| FORMULA | C16H22O4 |
| MOLECULAR WEIGHT (Da) | 278.3480 |
| ACCURATE MASS (Da) | 278.1518 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Paraconiothyrium |
| ORIGIN SPECIES | variabile |
| InChIKey | SFCGEIHSBRXLDW-DCIASYOESA-N |
| InChI | InChI=1S/C16H22O4/c1-10-8-20-16(19-4)7-12-5-6-13(17)11(2)14(12,3)9-15(10,16)18/h5-7,10-11,18H,8-9H2,1-4H3/t10-,11+,14-,15-,16+/m0/s1 |
| SMILES | C[C@H]1CO[C@]2([C@@]1(C[C@]3([C@@H](C(=O)C=CC3=C2)C)C)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Amand, Séverine; Vallet, Marine; Guedon, Laura; Genta-Jouve, Grégory; Wien, Frank; Mann, Stéphane; Dupont, Joëlle; Prado, Soizic; Nay, Bastien A Reactive Eremophilane and Its Antibacterial 2(1H)-Naphthalenone Rearrangement Product, Witnesses of a Microbial Chemical Warfare Organic Letters 2017 19 (15) 4038-4041. | ||
|---|---|---|---|
| DOI | 10.1021/acs.orglett.7b01788 | PMID | 28737947 |
