Glycoside
GD124458
Name:
Trimethylcitryl-Beta-D-GalactopyranosideFormula:
C15H24O12Smiles:
COC(=O)CC(CC(=O)OC)(OC1OC(CO)C(O)C(O)C1O)C(=O)OCAglycone:
COC(=O)CC(O)(CC(=O)OC)C(=O)OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.8 |
| AlogP: | -3.16 | Num_rotatable_bonds: | 8 |
| MolWt: | 396.35 | Num_heavy_atoms: | 27 |
| TPSA: | 178.28 | NumAromaticRings: | 0 |
Unique Aglycone
AD50278
Formula: C9H14O7
Smiles:
COC(=O)CC(O)(CC(=O)OC)C(=O)OC| HBA: | 7 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 5 |
| MolWt: | 234.2 | Num_heavy_atoms: | 16 |
| TPSA: | 99.13 | NumAromaticRings: | 0 |
