Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA032509
PROPERTIES
| NPAID | NPA032509 |
|---|---|
| CLUSTER ID | 83 |
| NODE ID | 78 |
| NAME | 6-acetylbisdethiobis(methylthio)gliotoxin |
| FORMULA | C17H22N2O5S2 |
| MOLECULAR WEIGHT (Da) | 398.5060 |
| ACCURATE MASS (Da) | 398.0970 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Dichotomomyces |
| ORIGIN SPECIES | cejpii |
| InChIKey | VXWHYQLJXLMKDT-WRFANHODSA-N |
| InChI | InChI=1S/C17H22N2O5S2/c1-10(21)24-12-7-5-6-11-8-16(25-3)14(22)18(2)17(9-20,26-4)15(23)19(16)13(11)12/h5-7,12-13,20H,8-9H2,1-4H3/t12-,13-,16+,17+/m0/s1 |
| SMILES | CS[C@]1(CO)C(=O)N2[C@H]3C(=CC=C[C@@H]3OC(C)=O)C[C@@]2(SC)C(=O)N1C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Harms, Henrik; Orlikova, Barbora; Ji, Seungwon; Nesaei-Mosaferan, Damun; König, Gabriele; Diederich, Marc Epipolythiodiketopiperazines from the Marine Derived Fungus Dichotomomyces cejpii with NF-κB Inhibitory Potential Marine Drugs 2015 13 (8) 4949-4966. | ||
|---|---|---|---|
| DOI | 10.3390/md13084949 | PMID | 26258781 |
