Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019656
PROPERTIES
| NPAID | NPA019656 |
|---|---|
| CLUSTER ID | 1520 |
| NODE ID | 1249 |
| NAME | Sirodesmin H |
| FORMULA | C20H26N2O8S |
| MOLECULAR WEIGHT (Da) | 454.5010 |
| ACCURATE MASS (Da) | 454.1410 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phoma |
| ORIGIN SPECIES | lingam |
| InChIKey | ITMLCHOGYDYPNT-OQIMMBKLSA-N |
| InChI | InChI=1S/C20H26N2O8S/c1-9-16(3,4)12(25)18(30-9)6-11-17(28,13(18)29-10(2)24)7-19-14(26)21(5)20(8-23,31-19)15(27)22(11)19/h9,11,13,23,28H,6-8H2,1-5H3/t9-,11-,13+,17+,18-,19-,20-/m1/s1 |
| SMILES | C[C@@H]1C(C(=O)[C@]2(O1)C[C@@H]3[C@]([C@@H]2OC(=O)C)(C[C@@]45N3C(=O)[C@@](S4)(N(C5=O)C)CO)O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pedras, M. Soledade C.; Abrams, Suzanne R.; Seguin-Swartz, Ginette ISOLATION OF THE FIRST NATURALLY OCCURRING EPIMONOTHIODIOXOPIPERAZINE, A FUNGAL TOXIN PRODUCED BY PHOMA LINGAM Tetrahedron Letters 1988 29 (28) 3471-3474. | ||
|---|---|---|---|
| DOI | 10.1016/0040-4039(88)85192-x | PMID | - |
