Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005067
PROPERTIES
| NPAID | NPA005067 |
|---|---|
| CLUSTER ID | 557 |
| NODE ID | 496 |
| NAME | methyl 4-(3,4-dihydroxybenzamido)butanoate |
| FORMULA | C12H15NO5 |
| MOLECULAR WEIGHT (Da) | 253.2540 |
| ACCURATE MASS (Da) | 253.0950 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | wentii EN-48 |
| InChIKey | NCUSLXOBXZICBK-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H15NO5/c1-18-11(16)3-2-6-13-12(17)8-4-5-9(14)10(15)7-8/h4-5,7,14-15H,2-3,6H2,1H3,(H,13,17) |
| SMILES | COC(=O)CCCNC(=O)C1=CC(=C(C=C1)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Li, Xin; Li, Xiao-Ming; Xu, Gang-Ming; Li, Chun-Shun; Wang, Bin-Gui Antioxidant metabolites from marine alga-derived fungus Aspergillus wentii EN-48 Phytochemistry Letters 2014 7 134-135. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytol.2013.11.008 | PMID | - |
