Glycoside
GD133141
Name:
methyl 3-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoateFormula:
C16H20O8Smiles:
COC(=O)C=Cc1ccccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COC(=O)C=Cc1ccccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 5 |
| MolWt: | 340.33 | Num_heavy_atoms: | 24 |
| TPSA: | 125.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD53900
Formula: C10H10O3
Smiles:
COC(=O)C=Cc1ccccc1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 2 |
| MolWt: | 178.19 | Num_heavy_atoms: | 13 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
