| Phytochemical Name : Myricitrin |
| PCNDIDM0174 |
| Pubchem CID : 5281673 |
| Molecular formula: C21H20O12 |
| Canonical SMILES : CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C(=C4)O)O)O)O)O)O |
Synonymes : Myricitrin|17912-87-7|Myricitroside|Myricetrin|Myricitrine|Myricetin 3-O-rhamnoside|Myricetol 3-rhamnoside|Myricetin 3-rhamnoside|Myricetin 3-O-alpha-L-rhamnopyranoside|UNII-5Z0ZO61WPJ|5Z0ZO61WPJ|MLS000574998|CHEBI:70082|NSC19803|EINECS 241-856-7|NSC 19803|NSC-19803|5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one|Rhamnoside,myricetin-3|SMR000232363|Myricetin 3-O-alpha-L-rhamnoside|3-((6-Deoxy-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-benzopyran-4-one|5,7-dihydroxy-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one|3,3',4',5,5',7-Hexahydroxyflavone, 3-rhamnoside|Flavone,3,3',4',5,5',7-hexahydroxy-,3-rhamnoside|MFCD00016930|3-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one|4H-1-Benzopyran-4-one, 3-[(6-deoxy-.alpha.-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-|5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-4H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside|Myricitrin (7)|3-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-benzopyran-4-one|4H-1-BENZOPYRAN-4-ONE, 3-((6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)OXY)-5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-|Myricetin 3-O-.alpha.-L-rhamnopyranoside|myricetin-3-rhamnoside|Myricetin 3- rhamnoside|Myricitrin (Myricitrine)|MYRICITRIN [INCI]|5,7-Dihydroxy-3-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-2-(3,4,5-trihydroxy-phenyl)-1-benzopyran-4-one|SCHEMBL226022|Myricitrin, analytical standard|CHEMBL522983|MEGxp0_000257|FEMA NO. 4491|ACon1_000103|BDBM34753|cid_5281673|DTXSID40170771|BDBM153266|HMS2218N08|5,7-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one|HY-N0152|Myricitrin, >=99.0% (HPLC)|AC-638|MYRICETIN 3-O-RHAMNOPYRANOSIDE|AKOS015896842|CCG-208406|NCGC00163596-01|NCGC00163596-02|5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one|BS-16289|CS-0007883|S2327|(3-PHENYLAMINOCARBONYLPHENYL)BORONICACID|MYRICETIN 3-O-.ALPHA.-L-RHAMNPYRONOSIDE|SR-01000712005|Myricitrin, primary pharmaceutical reference standard|Q6948223|SR-01000712005-3|3-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]chromen-4-one|3-[(6-deoxy-|A-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-benzopyran-4-one|5,7-dihydroxy-3-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yloxy)-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one|5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromone|5,7-dihydroxy-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2-(3,4,5-trihydroxyphenyl)-1-benzopyran-4-one |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 0.920 |
| Log Po/w (XLOGP3) : 0.510 |
| Log Po/w (WLOGP) : 0.190 |
| Log Po/w (MLOGP) : -2.320 |
| Log Po/w (SILICOS-IT) : -0.460 |
| Consensus Log Po/w : -0.230 |

