Glycoside
GD090515
Name:
NoneFormula:
C20H24O5N6Smiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)n(C(=O)c3ccc(C)cc3C)c(=N)nc21Aglycone:
Cc1ccc(C(=O)n2c(N)c3c(nc2=N)[N]C=N3)c(C)c1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 428.45 | Num_heavy_atoms: | 31 |
| TPSA: | 161.5 | NumAromaticRings: | 3 |
Unique Aglycone
AD39381
Formula: C14H13ON6
Smiles:
Cc1ccc(C(=O)n2c(N)c3c(nc2=N)[N]C=N3)c(C)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 1 |
| MolWt: | 281.3 | Num_heavy_atoms: | 21 |
| TPSA: | 111.22 | NumAromaticRings: | 2 |
