| Phytochemical Name : Isoquercetin |
| PCNDIDI0113 |
| Pubchem CID : 5280804 |
| Molecular formula: C21H20O12 |
| Canonical SMILES : C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O |
Synonymes : Isoquercitrin|Isoquercetin|482-35-9|Hirsutrin|3-Glucosylquercetin|Quercetin 3-glucoside|Quercetin 3-o-glucopyranoside|Quercetin 3-D-glucoside|Quercetol 3-monoglucoside|Quercetin 3-O-glucoside|Quercetol 3-glucoside|CONTIGOSIDE B|Isotrifoliin|quercetin-3-O-glucoside|Quercetin-3-O-glucopyranoside|Quercetin 3-monoglucoside|Glucosyl 3-quercetin|Quercetin 3-beta-glucoside|quercetin-3-glucoside|Quercetin 3-beta-O-glucoside|quercetin glucoside|Quercetin-3-glucose|Ronacare isoquercetin|Glucosyl-3-quercetin|Isoquercetin, (-)-|UNII-6HN2PC637T|NSC 115918|BRN 0100989|6HN2PC637T|CCRIS 9340|CHEBI:68352|quercetin 3-O-beta-D-glucopyranoside|NSC-115918|Quercetin 3.beta.-glucoside|CHEMBL250450|4-18-00-03493 (Beilstein Handbook Reference)|3,3',4',5,7-Pentahydroxyflavone 3-beta-glucoside|Q 5|Quercetin 3-O-.beta.-D-glucopyranoside|2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl beta-D-glucopyranoside|4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(3,4-dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one|Quercetin 3-beta-D-glucoside|NSC-407304|quercetin 3-O-beta-D-glucoside|2-(3,4-Dihidroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)-4H-chromen-4-one|SMR000466391|3-beta-D-Glucosylquercetin|hydroside|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one|Isoquercitrin (6)|MFCD00017746|ACACIA|3-glucoside isoquercitrin|Quercetin 3--D-glucoside|ISOQUERCITRIN [MI]|D04PBH|ISOQUERCETIN [INCI]|Quercetin 3-glucopyranoside|Quercetin 3-ss-D-glucoside|IQC-950AN|MLS000759532|MLS001424096|SCHEMBL181306|QUERCETIN 3beta-GLUCOSIDE|quercetin-3-beta-glucopyranoside|ACon1_002134|cid_5280804|cid_5378597|Quercetin 3- beta -D-glucoside|quercetin 3-O--D-glucofuranoside|3-o-beta-d-glucopyranosylquercetin|BDBM153265|HMS2051B17|quercetin-3-o-beta-glucopyranoside|HY-N1445|BDBM50241354|PDSP1_001363|PDSP2_001347|s3842|AKOS015896729|CCG-100967|DB12665|NC00217|Quercetin-3-O-beta-D-galactopyranoside|4H-1-benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-|4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3-(b-D-glucopyranosyloxy)-5,7-dihydroxy-|quercetin -3-O-beta-D-galactopyranoside|AS-35335|LS-39589|QUERCETIN-3-O-.BETA.-D-GLUCOSIDE|Quercetin 3-glucoside, analytical standard|QUERCETIN-3-.BETA.-GLUCOPYRANOSIDE|3-O-.BETA.-D-GLUCOPYRANOSYLQUERCETIN|CS-0016884|C05623|QUERCETIN 3-O-GLUCOPYRANOSIDE [WHO-DD]|AB00639942-06|Quercetin 3-beta-D-glucoside, >=90% (HPLC)|3,3',4',5,7-Pentahydroxyflavone 3-A-glucoside|A871939|3-Glucopyranosyloxy-3',4',5,7-tetrahydroxyflavone|Q-100268|Q6086296|BRD-K73991644-001-01-7|3,3'',4'',5,7-pentahydroxyflavone-3-beta-O-glucoside|Isoquercitrin, primary pharmaceutical reference standard|QUERCETIN 3-O-GLUCOSIDE (CONSTITUENT OF GINKGO)|3',4',5,7-TETRAHYDROXYFLAVONE-3-beta-D-GLUCOPYRANOSIDE|QUERCETIN 3-O-GLUCOSIDE (CONSTITUENT OF GINKGO) [DSC]|3',4',5,7-TETRAHYDROXYFLAVONE-3-.BETA.-D-GLUCOPYRANOSIDE|2-Hydroxy-4-(3,5,7-trihydroxy-4-oxo-4H-chromen-2-yl)phenyl b-D-glucopyranoside|2-(3,4-Dihydroxy-phenyl)-5,7-dihydroxy-3-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-chromen-4-one|2-(3,4-Dihydroxyphenyl)-3-(b-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one, 9CI|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)-4H-chromen-4-one|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)-4H-chromen-4-one|4H-1-BENZOPYRAN-4-ONE, 2- (3,4-DIHYDROXYPHENYL)-3- (SS-D-GLUCOFURANOSYLOXY)-5,7-DIHYDROXY-|4H-1-Benzopyran-4-one, 2-(3,4-dihydroxy-phenyl)-3-(.beta.-D-glucofuranosyloxy)-5,7-dihydroxy-|4H-1-BENZOPYRAN-4-ONE, 2-(3,4-DIHYDROXYPHENYL)-3-(.BETA.-D-GLUCOPYRANOSYLOXY)-5,7-DIHYDROXY-|4H-1-BENZOPYRAN-4-ONE, 2-(3,4-DIHYDROXYPHENYL)-3-(SS-D-GLUCOFURANOSYLOXY)-5,7-DIHYDROXY-|HW2 |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.110 |
| Log Po/w (XLOGP3) : 0.360 |
| Log Po/w (WLOGP) : -0.540 |
| Log Po/w (MLOGP) : -2.590 |
| Log Po/w (SILICOS-IT) : -0.590 |
| Consensus Log Po/w : -0.250 |

