Glycoside
GD154500
Name:
NoneFormula:
C16H21O7Cl3Smiles:
OCC1OC(CC2(CCl)OC(CCl)C(O)C2O)C(O)C(O)C1ClAglycone:
CC1OC(CO)C(Cl)C(O)C1OSugarmoiety:
OC1C(CCl)OC(O)(CCl)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 5 |
| MolWt: | 395.66 | Num_heavy_atoms: | 23 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD61358
Formula: C8H13O4Cl
Smiles:
CC1OC(CO)C(Cl)C(O)C1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 1 |
| MolWt: | 196.63 | Num_heavy_atoms: | 12 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
