Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015323
PROPERTIES
| NPAID | NPA015323 |
|---|---|
| CLUSTER ID | 4581 |
| NODE ID | 3346 |
| NAME | B-5354b |
| FORMULA | C21H31NO3 |
| MOLECULAR WEIGHT (Da) | 345.4830 |
| ACCURATE MASS (Da) | 345.2304 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Ruegeria |
| ORIGIN SPECIES | sp. SANK 71896 |
| InChIKey | WLYHWIFEWQXUPV-GEJAPMDVSA-N |
| InChI | InChI=1S/C21H31NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25-21(24)18-14-15-19(22)20(23)17-18/h7-8,12-15,17,23H,2-6,9-11,16,22H2,1H3/b8-7+,13-12+ |
| SMILES | CCCCCC/C=C/CCC/C=C/COC(=O)C1=CC(=C(C=C1)N)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | KONO, KEITA; TANAKA, MASAHIRO; MIZUNO, TADAYOSHI; KODAMA, KENTARO; OGITA, TAKESHI; KOHAMA, TAKAFUMI B-5354a, b and c, New Sphingosine Kinase Inhibitors, Produced by a Marine Bacterium. Taxonomy, Fermentation, Isolation, Physico-chemical Properties and Structure Determination Journal of Antibiotics 2000 53 (8) 753-758. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.53.753 | PMID | 11079796 |
