Glycoside
GD103364
Name:
NoneFormula:
C23H28O5N6Smiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)n(C(=O)C3(Cc4ccccc4C)CC3)c(=N)nc21Aglycone:
Cc1ccccc1CC1(C(=O)n2c(N)c3c(nc2=N)[N]C=N3)CC1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 468.51 | Num_heavy_atoms: | 34 |
| TPSA: | 161.5 | NumAromaticRings: | 3 |
Unique Aglycone
AD43748
Formula: C17H17ON6
Smiles:
Cc1ccccc1CC1(C(=O)n2c(N)c3c(nc2=N)[N]C=N3)CC1| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.36 | Num_heavy_atoms: | 24 |
| TPSA: | 111.22 | NumAromaticRings: | 2 |
