Glycoside
GD121030
Name:
2-[2-methoxy-4-(prop-1-en-1-yl)phenoxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triolFormula:
C21H30O11Smiles:
CC=Cc1ccc(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)c(OC)c1Aglycone:
CC=Cc1ccc(O)c(OC)c1Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | -1.63 | Num_rotatable_bonds: | 7 |
| MolWt: | 458.46 | Num_heavy_atoms: | 32 |
| TPSA: | 167.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD29405
Formula: C10H12O2
Smiles:
CC=Cc1ccc(O)c(OC)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 164.2 | Num_heavy_atoms: | 12 |
| TPSA: | 29.46 | NumAromaticRings: | 1 |
