Glycoside
GD030224
Name:
NoneFormula:
C28H36O10N2Smiles:
C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1c2c(O)ccc3[nH]cc(c23)CCN1CAglycone:
C=CC1C(O)OC=C(C(=O)OC)C1CC1c2c(O)ccc3[nH]cc(c23)CCN1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 7 |
| MolWt: | 560.6 | Num_heavy_atoms: | 40 |
| TPSA: | 174.17 | NumAromaticRings: | 2 |
Unique Aglycone
AD19568
Formula: C22H26O5N2
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1CC1c2c(O)ccc3[nH]cc(c23)CCN1C| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.41 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 4 |
| MolWt: | 398.46 | Num_heavy_atoms: | 29 |
| TPSA: | 95.02 | NumAromaticRings: | 2 |
