Glycoside
GD157539
Name:
4-[hydroxy({3-methoxy-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl})methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-oneFormula:
C26H32O11Smiles:
COc1cc(CC2C(=O)OCC2C(O)c2ccc(OC3OC(C)C(O)C(O)C3O)c(OC)c2)ccc1OAglycone:
COc1cc(CC2C(=O)OCC2C(O)c2ccc(O)c(OC)c2)ccc1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 8 |
| MolWt: | 520.53 | Num_heavy_atoms: | 37 |
| TPSA: | 164.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD14864
Formula: C20H22O7
Smiles:
COc1cc(CC2C(=O)OCC2C(O)c2ccc(O)c(OC)c2)ccc1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 374.39 | Num_heavy_atoms: | 27 |
| TPSA: | 105.45 | NumAromaticRings: | 2 |
