Glycoside
GD140969
Name:
2-[2,3-dihydroxy-3-(4-hydroxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H22O9Smiles:
OCC1OC(OCC(O)C(O)c2ccc(O)cc2)C(O)C(O)C1OAglycone:
OCC(O)C(O)c1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.6 |
| AlogP: | -2.4 | Num_rotatable_bonds: | 6 |
| MolWt: | 346.33 | Num_heavy_atoms: | 24 |
| TPSA: | 160.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD14254
Formula: C9H12O4
Smiles:
OCC(O)C(O)c1ccc(O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 3 |
| MolWt: | 184.19 | Num_heavy_atoms: | 13 |
| TPSA: | 80.92 | NumAromaticRings: | 1 |
