Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000205549 | Bronze | Massbank:CA000102&Spheroidenone |
COMPOUND NPA003875
PROPERTIES
| NPAID | NPA003875 |
|---|---|
| CLUSTER ID | 1539 |
| NODE ID | 1265 |
| NAME | Spheroidenone |
| FORMULA | C41H58O2 |
| MOLECULAR WEIGHT (Da) | 582.9130 |
| ACCURATE MASS (Da) | 582.4437 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Rhodospirillum |
| ORIGIN SPECIES | rubrum |
| InChIKey | ZQFURSYWJPLAJR-FZFXUSNISA-N |
| InChI | InChI=1S/C41H58O2/c1-33(2)19-14-22-36(5)25-17-28-37(6)26-15-23-34(3)20-12-13-21-35(4)24-16-27-38(7)29-18-30-39(8)31-32-40(42)41(9,10)43-11/h12-13,15-16,18-21,23-27,29-32H,14,17,22,28H2,1-11H3/b13-12+,23-15+,24-16+,29-18+,32-31+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+ |
| SMILES | CC(=CCC/C(=C/CC/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(=O)C(C)(C)OC)/C)/C)/C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Malhotra, HC; Britton, G; Goodwin, TW The identification of spheroidene and hydroxyspheroidene in diphenylamine-inhibited cultures of rhodospirillum rubrum Phytochemistry 1969 8 (6) 1047-1049. | ||
|---|---|---|---|
| DOI | 10.1016/s0031-9422(00)86354-2 | PMID | - |
