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CHEBI:217441 - (3S, 3'R)-adonixanthin-beta-D-glucoside
| Formula | C46H64O7 |
| Net Charge | 0 |
| Average Mass | 729.011 |
| Monoisotopic Mass | 728.46520 |
| SMILES | CC(C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)C(=O)C(C2OC(CO)C(O)C(O)C2O)CC1(C)C |
| InChI | InChI=1S/C46H64O7/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(48)26-45(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)40(49)36(27-46(38,9)10)44-43(52)42(51)41(50)39(28-47)53-44/h11-24,35-36,39,41-44,47-48,50-52H,25-28H2,1-10H3 |
| InChIKey | SAISBEBEOIHPOB-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Agrobacterium aurantiacum (ncbitaxon:44155) | - | DOI (10.1021/np50126a022) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3S, 3'R)-adonixanthin-beta-D-glucoside (CHEBI:217441) is a xanthophyll (CHEBI:27325) |
| IUPAC Name |
|---|
| 3-[18-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohex-2-en-1-one |