Glycoside
GD119320
Name:
methyl 4-(dimethoxymethyl)-3-ethenyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylateFormula:
C18H28O11Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1C(OC)OCAglycone:
C=CC1C(O)OC=C(C(=O)OC)C1C(OC)OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | -1.75 | Num_rotatable_bonds: | 8 |
| MolWt: | 420.41 | Num_heavy_atoms: | 29 |
| TPSA: | 153.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD47783
Formula: C12H18O6
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1C(OC)OC| HBA: | 6 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 5 |
| MolWt: | 258.27 | Num_heavy_atoms: | 18 |
| TPSA: | 74.22 | NumAromaticRings: | 0 |
