Glycoside
GD148173
Name:
5,7-dimethoxy-2-(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C24H28O11Smiles:
COc1cc(OC)c2c(c1)OC(c1ccc(OC3OC(CO)C(O)C(O)C3O)c(OC)c1)CC2=OAglycone:
COc1cc(OC)c2c(c1)OC(c1ccc(O)c(OC)c1)CC2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 492.48 | Num_heavy_atoms: | 35 |
| TPSA: | 153.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD59303
Formula: C18H18O6
Smiles:
COc1cc(OC)c2c(c1)OC(c1ccc(O)c(OC)c1)CC2=O| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.28 |
| AlogP: | 3.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 330.34 | Num_heavy_atoms: | 24 |
| TPSA: | 74.22 | NumAromaticRings: | 2 |
