Glycoside
GD139101
Name:
5-DeoxyeustomosideFormula:
C16H22O10Smiles:
O=C1OCCC2C1=COC(OC1OC(CO)C(O)C(O)C1O)C2C1CO1Aglycone:
O=C1OCCC2C1=COC(O)C2C1CO1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | -2.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 374.34 | Num_heavy_atoms: | 26 |
| TPSA: | 147.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD56099
Formula: C10H12O5
Smiles:
O=C1OCCC2C1=COC(O)C2C1CO1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.7 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 1 |
| MolWt: | 212.2 | Num_heavy_atoms: | 15 |
| TPSA: | 68.29 | NumAromaticRings: | 0 |
