Glycoside
GD140452
Name:
2-(hydroxymethyl)-6-{2-[2-(4-hydroxyphenyl)ethenyl]-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenoxy}oxane-3,4,5-triolFormula:
C26H32O12Smiles:
CC1OC(Oc2cccc(C=Cc3ccc(O)cc3)c2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
Oc1ccc(C=Cc2cccc(O)c2O)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.46 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 7 |
| MolWt: | 536.53 | Num_heavy_atoms: | 38 |
| TPSA: | 198.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD56634
Formula: C14H12O3
Smiles:
Oc1ccc(C=Cc2cccc(O)c2O)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.97 | Num_rotatable_bonds: | 2 |
| MolWt: | 228.25 | Num_heavy_atoms: | 17 |
| TPSA: | 60.69 | NumAromaticRings: | 2 |
