Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA007412
PROPERTIES
| NPAID | NPA007412 |
|---|---|
| CLUSTER ID | 779 |
| NODE ID | 118 |
| NAME | Oblongolide C |
| FORMULA | C14H20O3 |
| MOLECULAR WEIGHT (Da) | 236.3110 |
| ACCURATE MASS (Da) | 236.1412 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phomopsis |
| ORIGIN SPECIES | sp. |
| InChIKey | QSSKWTDLXGNHNM-GRLWGSQLSA-N |
| InChI | InChI=1S/C14H20O3/c1-9-3-4-11-10(7-9)5-6-14(16)8-17-12(15)13(11,14)2/h5-6,9-11,16H,3-4,7-8H2,1-2H3/t9-,10-,11-,13-,14-/m0/s1 |
| SMILES | C[C@H]1CC[C@H]2[C@H](C1)C=C[C@]3([C@@]2(C(=O)OC3)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Dai, Jingqiu; Krohn, Karsten; Gehle, Dietmar; Kock, Ines; Flörke, Ulrich; Aust, Hans-Jürgen; Draeger, Siegfried; Schulz, Barbara; Rheinheimer, Joachim New Oblongolides Isolated from the Endophytic Fungus Phomopsis sp. from Melilotus dentata from the Shores of the Baltic Sea European Journal of Organic Chemistry 2005 2005 (18) 3351-3359. | ||
|---|---|---|---|
| DOI | 10.1002/ejoc.200500290 | PMID | - |
