Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004741
PROPERTIES
| NPAID | NPA004741 |
|---|---|
| CLUSTER ID | 2412 |
| NODE ID | 28 |
| NAME | Kelsoene |
| FORMULA | C15H24 |
| MOLECULAR WEIGHT (Da) | 204.3570 |
| ACCURATE MASS (Da) | 204.1878 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. strain GWS-BW-H5 |
| InChIKey | UEHKTJFOLYEULK-YXJLRHLOSA-N |
| InChI | InChI=1S/C15H24/c1-9(2)13-12-7-8-15(12,4)11-6-5-10(3)14(11)13/h10-14H,1,5-8H2,2-4H3/t10-,11+,12+,13-,14-,15-/m1/s1 |
| SMILES | C[C@@H]1CC[C@H]2[C@@H]1[C@@H]([C@H]3[C@@]2(CC3)C)C(=C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | König, Gabriele M; Wright, Anthony D New and Unusual Sesquiterpenes: Kelsoene, Prespatane, Epi-γ-gurjunene, and T-Cadinthiol, from the Tropical Marine Sponge Cymbastela hooperi Journal of Organic Chemistry 1997 62 (12) 3837-3840. | ||
|---|---|---|---|
| DOI | 10.1021/jo970015o | PMID | - |
SYNTHESES
| CITATION 1 | Fietz-Razavian S; Schulz S; Dix I; Jones PG Revision of the absolute configuration of the tricyclic sesquiterpene (+)-kelsoene by chemical correlation and enantiospecific total synthesis of its enantiomer. Chemical Communications 2001 (20) 2154-5. DOI: 10.1039/b101579f PMID: 12240209 | ||
|---|---|---|---|
