Glycoside
GD024520
Name:
NoneFormula:
C24H23O6N4ClSmiles:
N#CC1(c2ccc3nn(Cc4cc([C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)ccc4Cl)c(=O)n3c2)CC1Aglycone:
N#CC1(c2ccc3nn(Cc4ccccc4Cl)c(=O)n3c2)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 5 |
| MolWt: | 486.91 | Num_heavy_atoms: | 34 |
| TPSA: | 153.24 | NumAromaticRings: | 3 |
Unique Aglycone
AD16351
Formula: C18H13ON4Cl
Smiles:
N#CC1(c2ccc3nn(Cc4ccccc4Cl)c(=O)n3c2)CC1| HBA: | 5 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.24 |
| AlogP: | 2.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 324.77 | Num_heavy_atoms: | 23 |
| TPSA: | 63.09 | NumAromaticRings: | 3 |
