Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA001556
PROPERTIES
NPAID | NPA001556 |
---|---|
CLUSTER ID | 26 |
NODE ID | 25 |
NAME | Enniatin J3 |
FORMULA | C32H55N3O9 |
MOLECULAR WEIGHT (Da) | 625.8040 |
ACCURATE MASS (Da) | 625.3938 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Fusarium |
ORIGIN SPECIES | sp. |
InChIKey | PKIONGFDDBDWQO-WOAYRZOOSA-N |
InChI | InChI=1S/C32H55N3O9/c1-15-20(10)23-32(41)44-26(19(8)9)28(37)34(13)22(16(2)3)31(40)43-24(17(4)5)27(36)33(12)21(11)30(39)42-25(18(6)7)29(38)35(23)14/h16-26H,15H2,1-14H3/t20-,21-,22-,23-,24+,25+,26+/m0/s1 |
SMILES | CC[C@H](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 |
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. | ||
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DOI | 10.1021/np0340448 | PMID | 15165149 |