Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000001615 | Gold | 1!CCMSLIB00000001616 |
COMPOUND NPA010536
PROPERTIES
| NPAID | NPA010536 |
|---|---|
| CLUSTER ID | 1552 |
| NODE ID | 1274 |
| NAME | Pacificanone A |
| FORMULA | C20H34O3 |
| MOLECULAR WEIGHT (Da) | 322.4890 |
| ACCURATE MASS (Da) | 322.2508 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Salinispora |
| ORIGIN SPECIES | pacifica |
| InChIKey | JSPPQWVTDRBUIB-VGPDEBLWSA-N |
| InChI | InChI=1S/C20H34O3/c1-7-17-12-15(5)20(23,16(6)19(17)22)10-9-13(3)11-14(4)18(21)8-2/h9-11,14-18,21,23H,7-8,12H2,1-6H3/b10-9+,13-11+/t14-,15+,16+,17-,18+,20+/m1/s1 |
| SMILES | CC[C@@H]1C[C@@H]([C@]([C@H](C1=O)C)(/C=C/C(=C/[C@@H](C)[C@H](CC)O)/C)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Oh, Dong-Chan; Gontang, Erin A.; Kauffman, Christopher A.; Jensen, Paul R.; Fenical, William Salinipyrones and pacificanones, mixed-precursor polyketides from the marine actinomycete Salinispora pacifica Journal of Natural Products 2008 71 (4) 570-575. | ||
|---|---|---|---|
| DOI | 10.1021/np0705155 | PMID | 18321059 |
