Glycoside
GD091220
Name:
NoneFormula:
C18H26O7N6Smiles:
CC[C@H](C)[C@H](NC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O)C(=O)OCAglycone:
CCC(C)C(NC(=O)Nc1ncnc2c1N=C[N]2)C(=O)OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 7 |
| MolWt: | 438.44 | Num_heavy_atoms: | 31 |
| TPSA: | 180.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD39769
Formula: C13H17O3N6
Smiles:
CCC(C)C(NC(=O)Nc1ncnc2c1N=C[N]2)C(=O)OC| HBA: | 9 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 305.32 | Num_heavy_atoms: | 22 |
| TPSA: | 119.67 | NumAromaticRings: | 1 |
