Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA009879
PROPERTIES
| NPAID | NPA009879 |
|---|---|
| CLUSTER ID | 3782 |
| NODE ID | 148 |
| NAME | Libertellenone C |
| FORMULA | C20H28O5 |
| MOLECULAR WEIGHT (Da) | 348.4390 |
| ACCURATE MASS (Da) | 348.1937 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Libertella |
| ORIGIN SPECIES | sp. |
| InChIKey | YFSWTQQLSUEQBY-CNVPOBLBSA-N |
| InChI | InChI=1S/C20H28O5/c1-5-17(2)8-9-20(25)12(10-17)14(23)15(24)16-18(3,11-21)7-6-13(22)19(16,20)4/h5,10,13,21-22,24-25H,1,6-9,11H2,2-4H3/t13-,17+,18+,19+,20-/m1/s1 |
| SMILES | C[C@@]1(CC[C@]2(C(=C1)C(=O)C(=C3[C@@]2([C@@H](CC[C@@]3(C)CO)O)C)O)O)C=C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Oh, Dong-Chan; Jensen, Paul R; Kauffman, Christopher A; Fenical, William Libertellenones A-D: induction of cytotoxic diterpenoid biosynthesis by marine microbial competition Bioorganic and Medicinal Chemistry 2005 13 (17) 5267-5273. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmc.2005.05.068 | PMID | 15993608 |
