Glycoside
GD003873
Name:
NoneFormula:
C24H24O6N7ClSmiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NCc4cc(Cl)ccc4OCc4cc(C)no4)ncnc32)[C@H](O)[C@H]1OAglycone:
Cc1cc(COc2ccc(Cl)cc2CNc2ncnc3c2N=C[N]3)on1Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 8 |
| MolWt: | 529.94 | Num_heavy_atoms: | 37 |
| TPSA: | 169.68 | NumAromaticRings: | 4 |
Unique Aglycone
AD03452
Formula: C18H14O2N6Cl
Smiles:
Cc1cc(COc2ccc(Cl)cc2CNc2ncnc3c2N=C[N]3)on1| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 3.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 369.79 | Num_heavy_atoms: | 26 |
| TPSA: | 99.53 | NumAromaticRings: | 3 |
