| Phytochemical Name : Ikarisoside C |
| PCNDIDI0010 |
| Pubchem CID : 13964057 |
| Molecular formula: C38H48O20 |
| 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)O)OC6C(C(C(C(O6)CO)O)O)O)O)O |
Synonymes : AKOS040736289|3-[(2S,3R,4R,5R,6S)-4,5-Dihydroxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.680 |
| Log Po/w (XLOGP3) : -0.260 |
| Log Po/w (WLOGP) : -2.410 |
| Log Po/w (MLOGP) : -4.670 |
| Log Po/w (SILICOS-IT) : -1.870 |
| Consensus Log Po/w : -1.310 |