Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017660
PROPERTIES
| NPAID | NPA017660 |
|---|---|
| CLUSTER ID | 16 |
| NODE ID | 16 |
| NAME | Dendrodolide B |
| FORMULA | C13H20O5 |
| MOLECULAR WEIGHT (Da) | 256.2980 |
| ACCURATE MASS (Da) | 256.1311 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Dendrodochium |
| ORIGIN SPECIES | sp. |
| InChIKey | FRGUXEKVISRIEL-YUSALJHKSA-N |
| InChI | InChI=1S/C13H20O5/c1-9-6-12(17-2)7-10(14)4-3-5-11(15)8-13(16)18-9/h3,5,9,11-12,15H,4,6-8H2,1-2H3/t9-,11-,12-/m1/s1 |
| SMILES | C[C@@H]1C[C@H](CC(=O)CC=C[C@H](CC(=O)O1)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Sun, Peng; Xu, Dong-Xiao; Mandi, Attila; Kurtan, Tibor; Li, Tie-Jun; Schulz, Barbara; Zhang, Wen Structure, absolute configuration, and conformational study of 12-membered macrolides from the fungus dendrodochium sp. associated with the sea cucumber holothuria nobilis selenka Journal of Organic Chemistry 2013 78 (14) 7030-7047. | ||
|---|---|---|---|
| DOI | 10.1021/jo400861j | PMID | 23767968 |
