Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000205580 | Bronze | Massbank:CA000140&Adonirubin |
COMPOUND NPA008097
PROPERTIES
| NPAID | NPA008097 |
|---|---|
| CLUSTER ID | 1378 |
| NODE ID | 1160 |
| NAME | Phoenicoxanthin |
| FORMULA | C40H52O3 |
| MOLECULAR WEIGHT (Da) | 580.8530 |
| ACCURATE MASS (Da) | 580.3916 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Micrococcus |
| ORIGIN SPECIES | roseus |
| InChIKey | OOUTWVMJGMVRQF-NWYYEFBESA-N |
| InChI | InChI=1S/C40H52O3/c1-28(17-13-19-30(3)21-23-34-32(5)36(41)25-26-39(34,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-35-33(6)38(43)37(42)27-40(35,9)10/h11-24,37,42H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t37-/m0/s1 |
| SMILES | CC1=C(C(CCC1=O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C(=O)[C@H](CC2(C)C)O)C)/C)/C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ungers, G E; Cooney, J J Isolation and characterization of carotenoid pigments of Micrococcus roseus Journal of Bacteriology 1968 96 (1) 234-241. | ||
|---|---|---|---|
| DOI | 10.5281/zenodo.3541244 | PMID | 5663569 |
