Glycoside
GD035848
Name:
NoneFormula:
C23H28O7N2Smiles:
CCCCCc1ccc(C#Cc2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(=O)nc2O)cc1Aglycone:
CCCCCc1ccc(C#Cc2c[nH]c(=O)nc2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 444.48 | Num_heavy_atoms: | 32 |
| TPSA: | 145.27 | NumAromaticRings: | 2 |
Unique Aglycone
AD22655
Formula: C17H18O2N2
Smiles:
CCCCCc1ccc(C#Cc2c[nH]c(=O)nc2O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 282.34 | Num_heavy_atoms: | 21 |
| TPSA: | 65.98 | NumAromaticRings: | 2 |
