Glycoside
GD115808
Name:
NoneFormula:
C16H22O12Smiles:
O=C(O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(=O)C2(O)COAglycone:
O=C(O)C1=COC(O)C2C1CC(=O)C2(O)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.75 |
| AlogP: | -3.94 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.34 | Num_heavy_atoms: | 28 |
| TPSA: | 203.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD45880
Formula: C10H12O7
Smiles:
O=C(O)C1=COC(O)C2C1CC(=O)C2(O)CO| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.2 | Num_heavy_atoms: | 17 |
| TPSA: | 124.29 | NumAromaticRings: | 0 |
