| Phytochemical Name : Didymin |
| PCNDIDD0114 |
| Pubchem CID : 16760075 |
| Molecular formula: C28H34O14 |
| Canonical SMILES : CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)OC)O)O)O)O)O)O)O |
Synonymes : Didymin|14259-47-3|Neoponcirin|Isosakuranetin-7-O-rutinoside|Didymine|02Q5OS3TU3|Isosakuranetin-7-beta-rutinoside|EINECS 238-139-6|Isosakuranetin 7-rutinoside|UNII-02Q5OS3TU3|CITRIFOLIOL-7-O-RUTINOSIDE|(2S)-5-hydroxy-2-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one|(S)-7-[[6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-4H-benzopyran-4-one|DIDYMIN (USP-RS)|DIDYMIN [USP-RS]|Isosakuranetin 7-O-rutinoside|4'-METHOXY-5,7-DIHYDROXYFLAVANONE 7-O-RUTINOSIDE|(S)-7-((6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-4H-benzopyran-4-one|4H-1-Benzopyran-4-one, 7-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-, (S)-|Didymin, analytical standard|Iso-sakuranetin-7-putinoside|SCHEMBL497764|DTXSID90931536|CHEBI:176179|HY-N2068|MFCD00151177|s9235|AKOS016010158|CCG-270180|CS-T-59226|NCGC00163539-01|AC-34874|AS-75739|CS-0018573|A885172|SR-05000002279|SR-05000002279-2|Q63399321|Z3235033284|FLAVANONE, 5,7-DIHYDROXY-4'-METHOXY-, 7beta-RUTINOSIDE|FLAVANONE, 5,7-DIHYDROXY-4'-METHOXY-, 7.BETA.-RUTINOSIDE|(2S)-7-((6-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-2,3-DIHYDRO-5-HYDROXY-2-(4-METHOXYPHENYL)-4H-1-BENZOPYRAN-4-ONE|(2S)-7-((6-O-(6-DEOXY-alpha-L-MANNOPYRANOSYL)-beta-D-GLUCOPYRANOSYL)OXY)-2,3-DIHYDRO-5-HYDROXY-2-(4-METHOXYPHENYL)-4H-1-BENZOPYRAN-4-ONE|(S)-5-hydroxy-2-(4-methoxyphenyl)-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yloxy)methyl)tetrahydro-2H-pyran-2-yloxy)chroman-4-one|4H-1-BENZOPYRAN-4-ONE, 7-((6-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-2,3-DIHYDRO-5-HYDROXY-2-(4-METHOXYPHENYL)-, (2S)-|4H-1-BENZOPYRAN-4-ONE, 7-((6-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-2,3-DIHYDRO-5-HYDROXY-2-(4-METHOXYPHENYL)-, (S)-|4H-1-BENZOPYRAN-4-ONE, 7-((6-O-(6-DEOXY-alpha-L-MANNOPYRANOSYL)-beta-D-GLUCOPYRANOSYL)OXY)-2,3-DIHYDRO-5-HYDROXY-2-(4-METHOXYPHENYL)-, (2S)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.350 |
| Log Po/w (XLOGP3) : 3.540 |
| Log Po/w (WLOGP) : 2.870 |
| Log Po/w (MLOGP) : 3.040 |
| Log Po/w (SILICOS-IT) : 3.740 |
| Consensus Log Po/w : 3.310 |