Glycoside
GD121690
Name:
2-(benzyloxy)-5-hydroxy-6-(hydroxymethyl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl acetateFormula:
C21H30O11Smiles:
CC(=O)OC1C(OCc2ccccc2)OC(CO)C(O)C1OC1OC(C)C(O)C(O)C1OAglycone:
OCc1ccccc1Sugarmoiety:
CC(=O)OC1C(O)OC(CO)C(O)C1OC1OC(C)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 7 |
| MolWt: | 458.46 | Num_heavy_atoms: | 32 |
| TPSA: | 164.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD00044
Formula: C7H8O
Smiles:
OCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
