Glycoside
GD021582
Name:
NoneFormula:
C20H28O7N2Smiles:
Cc1cc(O)ccc1Cc1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)n[nH]c1C(C)CAglycone:
Cc1cc(O)ccc1Cc1c(O)n[nH]c1C(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 6 |
| MolWt: | 408.45 | Num_heavy_atoms: | 29 |
| TPSA: | 148.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD14740
Formula: C14H18O2N2
Smiles:
Cc1cc(O)ccc1Cc1c(O)n[nH]c1C(C)C| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 2.84 | Num_rotatable_bonds: | 3 |
| MolWt: | 246.31 | Num_heavy_atoms: | 18 |
| TPSA: | 69.14 | NumAromaticRings: | 2 |
