Glycoside
GD148824
Name:
2-{[2-(2,5-dihydroxycyclopentyl)furan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H22O9Smiles:
OCC1OC(Oc2ccoc2C2C(O)CCC2O)C(O)C(O)C1OAglycone:
Oc1ccoc1C1C(O)CCC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.73 |
| AlogP: | -1.94 | Num_rotatable_bonds: | 4 |
| MolWt: | 346.33 | Num_heavy_atoms: | 24 |
| TPSA: | 152.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD59533
Formula: C9H12O4
Smiles:
Oc1ccoc1C1C(O)CCC1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.56 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 1 |
| MolWt: | 184.19 | Num_heavy_atoms: | 13 |
| TPSA: | 73.83 | NumAromaticRings: | 1 |
