Glycoside
GD130392
Name:
2-{2-hydroxy-4-[2-(3-hydroxy-4-methoxyphenyl)ethyl]-6-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C22H28O10Smiles:
COc1ccc(CCc2cc(O)c(OC3OC(CO)C(O)C(O)C3O)c(OC)c2)cc1OAglycone:
COc1ccc(CCc2cc(O)c(O)c(OC)c2)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 8 |
| MolWt: | 452.46 | Num_heavy_atoms: | 32 |
| TPSA: | 158.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD52842
Formula: C16H18O5
Smiles:
COc1ccc(CCc2cc(O)c(O)c(OC)c2)cc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 290.31 | Num_heavy_atoms: | 21 |
| TPSA: | 79.15 | NumAromaticRings: | 2 |
