Lusitanicoside
(2S,3R,4R,5R,6R)-2-methyl-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
Also Known As: Lusitanicoside|Chavicol beta-rutinoside|MolPort-005-945-865|NCGC00386037-01|J1.747.364F|(2S,3R,4R,5R,6R)-2-methyl-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol|4-Allylphenyl 6-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside|4-Allylphenyl 6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranoside|1-O-(6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosyl)-4-allylbenzene|4-(2-Propenyl)phenyl 6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranoside|4-(Prop-2-en-1-yl)phenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|(2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6S)-6-(4-allylphenoxy)-3,4,5-trihydroxy-tetrahydropyran-2-yl]methoxy]-6-methyl-tetrahydropyran-3,4,5-triol|(2S,3R,4R,5R,6R)-2-methyl-6-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-(prop-2-en-1-yl)phenoxy]oxan-2-yl]methoxy}oxane-3,4,5-triol
| Molecular Formula | C21H30O10 |
|---|---|
| Molecular Weight | 442.1839 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.1839 |
| Monoisotopic Mass | 442.1839 |
| Heavy Atoms | 31 |
| Complexity | 568.0 |
Chemical Identifiers
| CAS Number | 499-35-4 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC=C(C=C3)CC=C)O)O)O)O)O)O |
| InChIKey | DAELTTGCCPRYTP-ZLQZEYEISA-N |
Product Overview
Lusitanicoside (CAS 499-35-4), with molecular formula C21H30O10 and molecular weight 442.1839 g/mol. IUPAC: (2S,3R,4R,5R,6R)-2-methyl-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol.