| Phytochemical Name : Epimedin B |
| PCNDIDE0038 |
| Pubchem CID : 5748393 |
| Molecular formula: C38H48O19 |
| Canonical SMILES : CC1C(C(C(C(O1)OC2=C(OC3=C(C2=O)C(=CC(=C3CC=C(C)C)OC4C(C(C(C(O4)CO)O)O)O)O)C5=CC=C(C=C5)OC)OC6C(C(C(CO6)O)O)O)O)O |
Synonymes : Epimedin B|Epmedin B|110623-73-9|3-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one|Epimedin-B|C38H48O19|SCHEMBL3674180|DTXSID40149341|CHEBI:169048|EX-A6792|HY-N0259|s9268|AKOS016002028|AC-6040|CCG-270501|CS-3677|C38-H48-O19|MS-31497|A894871|Q-100061|3-[(6-Deoxy-2-O-beta-D-xylopyranosyl-alpha-L-mannopyranosyloxy)]-7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-methoxy-phenyl)-8-(3-methylbut-2-en-1-yl)-4H-chromen-4-one|4H-1-Benzopyran-4-one, 3-((6-deoxy-2-O-beta-D-xylopyranosyl-alpha-L-mannopyranosyl)oxy)-7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.800 |
| Log Po/w (XLOGP3) : 0.140 |
| Log Po/w (WLOGP) : -1.470 |
| Log Po/w (MLOGP) : -3.950 |
| Log Po/w (SILICOS-IT) : -0.840 |
| Consensus Log Po/w : -0.460 |