EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C40H52O3 |
| Net Charge | 0 |
| Average Mass | 580.853 |
| Monoisotopic Mass | 580.39165 |
| SMILES | CC1=C(/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)C(=O)[C@@H](O)CC2(C)C)C(C)(C)CCC1=O |
| 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 |
| InChIKey | OOUTWVMJGMVRQF-NWYYEFBESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Phoenicoxanthin (CHEBI:80216) is a xanthophyll (CHEBI:27325) |
| Synonym | Source |
|---|---|
| Adonirubin | KEGG COMPOUND |