Glycoside
GD146618
Name:
2-{4-[1,3-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)propyl]-2-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C23H30O11Smiles:
COc1cc(C(CO)C(O)c2ccc(OC3OC(CO)C(O)C(O)C3O)c(OC)c2)ccc1OAglycone:
COc1cc(C(O)C(CO)c2ccc(O)c(OC)c2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.48 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 9 |
| MolWt: | 482.48 | Num_heavy_atoms: | 34 |
| TPSA: | 178.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD47505
Formula: C17H20O6
Smiles:
COc1cc(C(O)C(CO)c2ccc(O)c(OC)c2)ccc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 6 |
| MolWt: | 320.34 | Num_heavy_atoms: | 23 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
