Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000001641 | Gold | 1!CCMSLIB00000001643 |
COMPOUND NPA006020
PROPERTIES
| NPAID | NPA006020 |
|---|---|
| CLUSTER ID | 2872 |
| NODE ID | 2208 |
| NAME | Saliniketal A |
| FORMULA | C22H37NO5 |
| MOLECULAR WEIGHT (Da) | 395.5400 |
| ACCURATE MASS (Da) | 395.2672 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Salinispora |
| ORIGIN SPECIES | arenicola |
| InChIKey | GRVRRAOIXXYICO-XVBWCICRSA-N |
| InChI | InChI=1S/C22H37NO5/c1-12(8-7-9-13(2)21(23)26)18(24)15(4)19(25)16(5)20-14(3)17-10-11-22(6,27-17)28-20/h7-9,12,14-20,24-25H,10-11H2,1-6H3,(H2,23,26)/b8-7+,13-9-/t12-,14+,15+,16+,17-,18-,19+,20+,22-/m0/s1 |
| SMILES | C[C@@H]1[C@@H]2CC[C@@](O2)(O[C@H]1[C@H](C)[C@@H]([C@H](C)[C@H]([C@@H](C)/C=C/C=C(/C)\C(=O)N)O)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Williams, Philip G.; Asolkar, Ratnakar N.; Kondratyuk, Tamara; Pezzuto, John M.; Jensen, Paul R.; Fenical, William Saliniketals A and B, bicyclic polyketides from the marine actinomycete Salinispora arenicola Journal of Natural Products 2007 70 (1) 83-88. | ||
|---|---|---|---|
| DOI | 10.1021/np0604580 | PMID | 17253854 |
