Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA009654
PROPERTIES
| NPAID | NPA009654 |
|---|---|
| CLUSTER ID | 3972 |
| NODE ID | 2963 |
| NAME | Victorin D |
| FORMULA | C31H45Cl3N6O12 |
| MOLECULAR WEIGHT (Da) | 800.0900 |
| ACCURATE MASS (Da) | 798.2161 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Cochliobolus |
| ORIGIN SPECIES | victoriae |
| InChIKey | YTVZGOJWFDPCMG-LVANQBLFSA-N |
| InChI | InChI=1S/C31H45Cl3N6O12/c1-12(2)23-22(28(46)38-17(11-32)26(44)37-16(30(48)49)10-14-18(41)6-7-20(14)52-23)40-27(45)21(19(42)5-4-8-35)39-25(43)15(9-13(3)24(33)34)36-29(47)31(50)51/h11-13,15-16,19,21-24,31,42,50-51H,4-10,35H2,1-3H3,(H,36,47)(H,37,44)(H,38,46)(H,39,43)(H,40,45)(H,48,49)/b17-11+/t13?,15-,16?,19+,21-,22?,23-/m0/s1 |
| SMILES | CC(C)[C@H]1C(C(=O)N/C(=C/Cl)/C(=O)NC(CC2=C(O1)CCC2=O)C(=O)O)NC(=O)[C@H]([C@@H](CCCN)O)NC(=O)[C@H](CC(C)C(Cl)Cl)NC(=O)C(O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wolpert, T. J.; Macko, V.; Acklin, W.; Jaun, B.; Arigoni, D. Structure of minor host-selective toxins from Cochliobolus victoriae. Experientia 1986 42 (11-12) 1296-1299. | ||
|---|---|---|---|
| DOI | 10.1007/bf01946431 | PMID | - |
