Glycoside
GD084146
Name:
NoneFormula:
C19H28O5N6Smiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)n(C(=O)C3C(C)(C)C3(C)C)c(=N)nc21Aglycone:
CC1(C)C(C(=O)n2c(N)c3c(nc2=N)[N]C=N3)C1(C)CSugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 420.47 | Num_heavy_atoms: | 30 |
| TPSA: | 161.5 | NumAromaticRings: | 2 |
Unique Aglycone
AD37554
Formula: C13H17ON6
Smiles:
CC1(C)C(C(=O)n2c(N)c3c(nc2=N)[N]C=N3)C1(C)C| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 273.32 | Num_heavy_atoms: | 20 |
| TPSA: | 111.22 | NumAromaticRings: | 1 |
