Glycoside
GD084264
Name:
NoneFormula:
C20H26O7NClSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@]2(c3ccc(Cl)cc3)C[C@H](O)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)C1(c2ccc(Cl)cc2)CC(O)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 415.87 | Num_heavy_atoms: | 28 |
| TPSA: | 128.48 | NumAromaticRings: | 1 |
Unique Aglycone
AD37612
Formula: C14H16O3NCl
Smiles:
O=C(NCCO)C1(c2ccc(Cl)cc2)CC(O)C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 4 |
| MolWt: | 269.73 | Num_heavy_atoms: | 18 |
| TPSA: | 69.56 | NumAromaticRings: | 1 |
