Glycoside
GD133531
Name:
3-hydroxy-4-oxo-4-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]butanoic acidFormula:
C10H16O10Smiles:
O=C(O)CC(O)C(=O)OCC1OC(O)C(O)C(O)C1OAglycone:
COC(=O)C(O)CC(=O)OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.8 |
| AlogP: | -3.83 | Num_rotatable_bonds: | 5 |
| MolWt: | 296.23 | Num_heavy_atoms: | 20 |
| TPSA: | 173.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD46285
Formula: C5H8O5
Smiles:
COC(=O)C(O)CC(=O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 148.11 | Num_heavy_atoms: | 10 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
