Glycoside
GD156350
Name:
5-[5-hydroxy-2,3-dimethoxy-4-(1,2,3-trihydroxy-3-phenylpropyl)phenoxy]-6-(hydroxymethyl)oxane-2,3,4-triolFormula:
C23H30O12Smiles:
COc1c(OC2C(CO)OC(O)C(O)C2O)cc(O)c(C(O)C(O)C(O)c2ccccc2)c1OCAglycone:
COc1c(O)cc(O)c(C(O)C(O)C(O)c2ccccc2)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.48 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 9 |
| MolWt: | 498.48 | Num_heavy_atoms: | 35 |
| TPSA: | 198.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD54306
Formula: C17H20O7
Smiles:
COc1c(O)cc(O)c(C(O)C(O)C(O)c2ccccc2)c1OC| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 336.34 | Num_heavy_atoms: | 24 |
| TPSA: | 119.61 | NumAromaticRings: | 2 |
