Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014634
PROPERTIES
| NPAID | NPA014634 |
|---|---|
| CLUSTER ID | 5197 |
| NODE ID | 3719 |
| NAME | Methyl (Z)-4-{[(Z)-1-(hydroxymethyl)-2-phenyl-1-ethenyl] amino}-4-oxo-2-butenoate |
| FORMULA | C14H15NO4 |
| MOLECULAR WEIGHT (Da) | 261.2770 |
| ACCURATE MASS (Da) | 261.1001 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | niger |
| InChIKey | HHNMWAFTDSRKBX-JNWHFCKMSA-N |
| InChI | InChI=1S/C14H15NO4/c1-19-14(18)8-7-13(17)15-12(10-16)9-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3,(H,15,17)/b8-7-,12-9- |
| SMILES | COC(=O)/C=C\C(=O)N/C(=C\C1=CC=CC=C1)/CO |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yuan†, Wei; Zhu†, Huixin; Cheng, Kedi; Huang, Zhentai; Qin, Yong; Yang, Jinling; Zhu, Ping A novel butenoate derivative from Aspergillus niger Natural Product Research 2006 20 (6) 573-577. | ||
|---|---|---|---|
| DOI | 10.1080/14786410500184157 | PMID | 16835090 |
