Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000577703 | Gold | 3 |
COMPOUND NPA000512
PROPERTIES
| NPAID | NPA000512 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Enniatin J1 |
| FORMULA | C31H53N3O9 |
| MOLECULAR WEIGHT (Da) | 611.7770 |
| ACCURATE MASS (Da) | 611.3782 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Fusarium |
| ORIGIN SPECIES | sp. strain F31 |
| InChIKey | IEUFDXNGDNWAKU-MAKNZWJESA-N |
| InChI | InChI=1S/C31H53N3O9/c1-15(2)21-30(39)42-23(17(5)6)26(35)32(12)20(11)29(38)41-24(18(7)8)27(36)33(13)22(16(3)4)31(40)43-25(19(9)10)28(37)34(21)14/h15-25H,1-14H3/t20-,21-,22-,23+,24+,25+/m0/s1 |
| SMILES | C[C@H]1C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N1C)C(C)C)C(C)C)C)C(C)C)C(C)C)C)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pohanka, Anton; Capieau, Kristof; Broberg, Anders; Stenlid, Jan; Stenstroem, Elna; Kenne, Lennart Enniatins of Fusarium sp. strain F31 and their inhibition of Botrytis cinerea spore germination Journal of Natural Products 2004 67 (5) 851-857. | ||
|---|---|---|---|
| DOI | 10.1021/np0340448 | PMID | 15165149 |
