Glycoside
GD000084
Name:
2-{2-hydroxy-3-methoxy-6-[2-(3,4,5-trimethoxyphenyl)ethyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C24H32O11Smiles:
COc1ccc(CCc2cc(OC)c(OC)c(OC)c2)c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1OAglycone:
COc1ccc(CCc2cc(OC)c(OC)c(OC)c2)c(O)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 10 |
| MolWt: | 496.51 | Num_heavy_atoms: | 35 |
| TPSA: | 156.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD00110
Formula: C18H22O6
Smiles:
COc1ccc(CCc2cc(OC)c(OC)c(OC)c2)c(O)c1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 2.92 | Num_rotatable_bonds: | 7 |
| MolWt: | 334.37 | Num_heavy_atoms: | 24 |
| TPSA: | 77.38 | NumAromaticRings: | 2 |
