Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004394
PROPERTIES
| NPAID | NPA004394 |
|---|---|
| CLUSTER ID | 2290 |
| NODE ID | 1814 |
| NAME | Isoharzianic acid |
| FORMULA | C19H27NO6 |
| MOLECULAR WEIGHT (Da) | 365.4260 |
| ACCURATE MASS (Da) | 365.1838 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | sp. |
| InChIKey | FQSWTHMMNDRFAI-BSOCMFCZSA-N |
| InChI | InChI=1S/C19H27NO6/c1-5-6-7-8-9-10-14(21)15-16(22)13(20(4)17(15)23)11-19(26,12(2)3)18(24)25/h7-10,12-13,21,26H,5-6,11H2,1-4H3,(H,24,25)/t13-,19?/m1/s1 |
| SMILES | CCCC=CC=CC(=C1C(=O)[C@H](N(C1=O)C)CC(C(C)C)(C(=O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Vinale, Francesco; Manganiello, Gelsomina; Nigro, Marco; Mazzei, Pierluigi; Piccolo, Alessandro; Pascale, Alberto; Ruocco, Michelina; Marra, Roberta; Lombardi, Nadia; Lanzuise, Stefania; Varlese, Rosaria; Cavallo, Pierpaolo; Lorito, Matteo; Woo, Sheridan L. A novel fungal metabolite with beneficial properties for agricultural applications Molecules 2014 19 (7) 9760-9772. | ||
|---|---|---|---|
| DOI | 10.3390/molecules19079760 | PMID | 25006784 |
