Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA013315
PROPERTIES
NPAID | NPA013315 |
---|---|
CLUSTER ID | 26 |
NODE ID | 25 |
NAME | Enniatin O3 |
FORMULA | C35H63N3O9 |
MOLECULAR WEIGHT (Da) | 669.9010 |
ACCURATE MASS (Da) | 669.4564 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Verticillium |
ORIGIN SPECIES | hemipterigenum BCC 1449 |
InChIKey | UBTDCNJVVJEHMG-WFQSNVLJSA-N |
InChI | InChI=1S/C35H63N3O9/c1-16-23(12)29-32(41)38(15)26(20(6)7)35(44)46-28(22(10)11)31(40)37(14)25(19(4)5)34(43)45-27(21(8)9)30(39)36(13)24(17-18(2)3)33(42)47-29/h18-30,39H,16-17H2,1-15H3/t23?,24-,25-,26-,27+,28+,29+,30?/m0/s1 |
SMILES | CCC(C)[C@@H]1C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(N([C@H](C(=O)O1)CC(C)C)C)O)C(C)C)C(C)C)C)C(C)C)C(C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Supothina, Sumalee; Isaka, Masahiko; Kirtikara, Kanyawim; Tanticharoen, Morakot; Thebtaranonth, Yodhathai Enniatin production by the entomopathogenic fungus Verticillium hemipterigenum BCC 1449 Journal of Antibiotics 2004 57 (11) 732-738. | ||
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DOI | 10.7164/antibiotics.57.732 | PMID | 15712668 |