Glycoside
GD158129
Name:
4-methoxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzaldehydeFormula:
C14H18O8Smiles:
COc1ccc(C=O)cc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1ccc(C=O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 314.29 | Num_heavy_atoms: | 22 |
| TPSA: | 125.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD42290
Formula: C8H8O3
Smiles:
COc1ccc(C=O)cc1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 152.15 | Num_heavy_atoms: | 11 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
