Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017345
PROPERTIES
| NPAID | NPA017345 |
|---|---|
| CLUSTER ID | 1378 |
| NODE ID | 1160 |
| NAME | Flexixanthin |
| FORMULA | C40H54O3 |
| MOLECULAR WEIGHT (Da) | 582.8690 |
| ACCURATE MASS (Da) | 582.4073 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Flexibacter |
| ORIGIN SPECIES | sp. |
| InChIKey | LLKMUZAISVDKFO-YGKMADHZSA-N |
| InChI | InChI=1S/C40H54O3/c1-30(19-13-21-32(3)22-14-23-33(4)25-16-28-40(9,10)43)17-11-12-18-31(2)20-15-24-34(5)26-27-36-35(6)38(42)37(41)29-39(36,7)8/h11-27,37,41,43H,28-29H2,1-10H3/b12-11+,19-13+,20-15+,22-14+,25-16-,27-26+,30-17+,31-18+,32-21+,33-23+,34-24+ |
| SMILES | CC1=C(C(CC(C1=O)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C\CC(C)(C)O)/C)/C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Aasen, A J; Jensen, S L Carotenoids of flexibacteria. 3. The structures of flexixanthin and deoxy-flexixanthin Acta Chemica Scandinavica 1966 20 (7) 1970-1988. | ||
|---|---|---|---|
| DOI | 10.3891/acta.chem.scand.20-1970 | PMID | 5973663 |
