| Phytochemical Name : Idaein |
| PCNDIDI0009 |
| Pubchem CID : 176457 |
| Molecular formula: C21H21ClO11 |
| Canonical SMILES : C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O.[Cl-] |
Synonymes : 27661-36-5|Idaein chloride|Idein chloride|Ideanin|Idein|Idaein|Ideain|CYANIDIN-3-GALACTOSIDE CHLORIDE|Cyanidin 3-O-galactoside chloride|Cyanidin-3-O-galactoside chloride|Cyanidin 3-galactoside chloride|cyanidin-3-o-galactoside|UNII-FC7L938Y12|FC7L938Y12|Cyanidin chloride 3-galactoside [MI]|Cyanidin 3-O-beta-galactopyranoside chloride|3-(Galactosyloxy)-3',4',5,7-tetrahydroxyflavylium chloride|CHEBI:37664|Cyanidin 3-O-beta-D-Galactopyranoside Chloride|Cyanidin-3-O-galactoside (chloride)|2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)chromenylium chloride|cyanidin 3-O-beta-D-galactoside chloride|(2S,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;chloride|1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(beta-d-galactopyranosyloxy)-5,7-dihydroxy-, chloride|3-(beta-D-galactopyranosyloxy)-3',4',5,7-tetrahydroxyflavylium chloride|27214-71-7|Cy3-gal|Idaein chloride, HPLC Grade|Cyanidin galactoside; Cyanindin-3-Gal; Idaein; Ideain; Ideanin|SCHEMBL316825|CHEMBL591992|Cyanidin chloride 3-galactoside|HY-N4142|Idaein chloride, >=90% (HPLC)|Idaein chloride, analytical standard|MFCD00270387|AKOS025311473|AC-34781|AS-78164|CS-0032217|Cyanidin 3-O- beta -D-Galactopyranoside Chloride|W-202159|CYANIDIN 3-O-.BETA.-GALACTOPYRANOSIDE CHLORIDE|CYANIDIN 3-O-.BETA.-D-GALACTOPYRANOSIDE CHLORIDE|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-chromeniumyl beta-D-galactopyranoside chloride|1-BENZOPYRYLIUM, 2-(3,4-DIHYDROXYPHENYL)-3-(.BETA.-D-GALACTOPYRANOSYLOXY)-5,7-DIHYDROXY-, CHLORIDE|1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(beta-D-galactopyranosyloxy)-5,7-dihydroxy-, chloride (1:1)|1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(ss-D-galactopyranosyloxy)-5,7-dihydroxy-, chloride (1:1)|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)chromenylium chloride |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : -4.820 |
| Log Po/w (XLOGP3) : 0.940 |
| Log Po/w (WLOGP) : -2.610 |
| Log Po/w (MLOGP) : -1.540 |
| Log Po/w (SILICOS-IT) : -1.910 |
| Consensus Log Po/w : -1.990 |