Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001870
PROPERTIES
| NPAID | NPA001870 |
|---|---|
| CLUSTER ID | 1178 |
| NODE ID | 1003 |
| NAME | Ascosetin |
| FORMULA | C26H37NO5 |
| MOLECULAR WEIGHT (Da) | 443.5840 |
| ACCURATE MASS (Da) | 443.2672 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp. |
| InChIKey | AAOOVFKOTYJAEJ-WYHHKWTJSA-N |
| InChI | InChI=1S/C26H37NO5/c1-13(2)9-19-23(30)21(25(32)27-19)24(31)26(6)18-8-7-14(3)10-17(18)11-15(4)22(26)16(5)12-20(28)29/h11-14,17-19,22,31H,7-10H2,1-6H3,(H,27,32)(H,28,29)/t14-,17+,18-,19?,22+,26+/m1/s1 |
| SMILES | C[C@@H]1CC[C@@H]2[C@@H](C1)C=C([C@H]([C@@]2(C)C(=C3C(=O)C(NC3=O)CC(C)C)O)C(=CC(=O)O)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ondeyka, John G; Smith, Scott K; Zink, Deborah L; Vicente, Francisca; Basilio, Angela; Bills, Gerald F; Polishook, Jon D; Garlisi, Charles; McGuinness, Debra; Smith, Elizabeth; Qiu, Hongchen; Gill, Charles J; Donald, Robert Gk; Phillips, John W; Goetz, Michael A; Singh, Sheo B Isolation, structure elucidation and antibacterial activity of a new tetramic acid, ascosetin Journal of Antibiotics 2014 67 (7) 527-531. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2014.33 | PMID | 24690911 |
