RefMet Compound Details
MW structure | 157588 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Astaxanthin glucoside | |
Systematic name | (6S)-6-hydroxy-2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-[(4S)-2,6,6-trimethyl-3-oxo-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexen-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-one | |
SMILES | C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)C(=O)[C@H](CC1(C)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)/C=C/C=C(\C)/C=C/C1=C(C)C(=O)[C@H](CC1(C)C)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 758.439385 (neutral) |