Glycoside
GD131333
Name:
2-(hydroxymethyl)-6-[3-(3,4,5-trimethoxyphenyl)propoxy]oxane-3,4,5-triolFormula:
C18H28O9Smiles:
COc1cc(CCCOC2OC(CO)C(O)C(O)C2O)cc(OC)c1OCAglycone:
COc1cc(CCCO)cc(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 9 |
| MolWt: | 388.41 | Num_heavy_atoms: | 27 |
| TPSA: | 127.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD53211
Formula: C12H18O4
Smiles:
COc1cc(CCCO)cc(OC)c1OC| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 6 |
| MolWt: | 226.27 | Num_heavy_atoms: | 16 |
| TPSA: | 47.92 | NumAromaticRings: | 1 |
