Glycoside
GD091442
Name:
NoneFormula:
C21H24O5N6Smiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)n(C(=O)c3ccc4c(c3)CCC4)c(=N)nc21Aglycone:
N=c1nc2c(c(N)n1C(=O)c1ccc3c(c1)CCC3)N=C[N]2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 440.46 | Num_heavy_atoms: | 32 |
| TPSA: | 161.5 | NumAromaticRings: | 3 |
Unique Aglycone
AD39898
Formula: C15H13ON6
Smiles:
N=c1nc2c(c(N)n1C(=O)c1ccc3c(c1)CCC3)N=C[N]2| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 1 |
| MolWt: | 293.31 | Num_heavy_atoms: | 22 |
| TPSA: | 111.22 | NumAromaticRings: | 2 |
