Glycoside
GD090961
Name:
NoneFormula:
C21H22O5N6Smiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)n(C(=O)C3=Cc4ccccc4C3)c(=N)nc21Aglycone:
N=c1nc2c(c(N)n1C(=O)C1=Cc3ccccc3C1)N=C[N]2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 438.44 | Num_heavy_atoms: | 32 |
| TPSA: | 161.5 | NumAromaticRings: | 3 |
Unique Aglycone
AD39612
Formula: C15H11ON6
Smiles:
N=c1nc2c(c(N)n1C(=O)C1=Cc3ccccc3C1)N=C[N]2| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 291.29 | Num_heavy_atoms: | 22 |
| TPSA: | 111.22 | NumAromaticRings: | 2 |
