Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006094
PROPERTIES
| NPAID | NPA006094 |
|---|---|
| CLUSTER ID | 2895 |
| NODE ID | 2224 |
| NAME | 7-(3-butanonyl)-6,6-dimethyl-2-cyclohex-4-none-2-carboxylic acid |
| FORMULA | C13H18O4 |
| MOLECULAR WEIGHT (Da) | 238.2830 |
| ACCURATE MASS (Da) | 238.1205 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | platensis |
| InChIKey | YHNGXQALPYIXQZ-NSHDSACASA-N |
| InChI | InChI=1S/C13H18O4/c1-8(14)4-5-11-10(12(16)17)6-9(15)7-13(11,2)3/h6,11H,4-5,7H2,1-3H3,(H,16,17)/t11-/m0/s1 |
| SMILES | CC(=O)CC[C@H]1C(=CC(=O)CC1(C)C)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Chaowei; Ondeyka, John; Dietrich, Lisa; Gailliot, Francis P; Hesse, Michelle; Lester, Michael; Dorso, Karen; Motyl, Mary; Ha, Sookhee N; Wang, Jun; Singh, Sheo B Isolation, structure and biological activities of platencin A(2)-A(4) from Streptomyces platensis Bioorganic and Medicinal Chemistry 2010 18 (7) 2602-2610. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmc.2010.02.030 | PMID | 20299229 |
