Glycoside
GD148838
Name:
{3,4,5-trihydroxy-6-[(4-methyl-5-oxooxolan-3-yl)oxy]oxan-2-yl}methyl 3-phenylprop-2-enoateFormula:
C20H24O9Smiles:
CC1C(=O)OCC1OC1OC(COC(=O)C=Cc2ccccc2)C(O)C(O)C1OAglycone:
CC1C(=O)OCC1O.COC(=O)C=Cc1ccccc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 6 |
| MolWt: | 408.4 | Num_heavy_atoms: | 29 |
| TPSA: | 131.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD00648
Formula: C10H10O2
Smiles:
COC(=O)C=Cc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.1 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 162.19 | Num_heavy_atoms: | 12 |
| TPSA: | 26.3 | NumAromaticRings: | 1 |
AD44887
Formula: C5H8O3
Smiles:
CC1C(=O)OCC1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 0 |
| MolWt: | 116.12 | Num_heavy_atoms: | 8 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
