Glycoside
GD084165
Name:
NoneFormula:
C18H25O6N5Smiles:
CCOC(=O)[C@H]1CCCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1Aglycone:
CCOC(=O)C1CCCN(c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 5 |
| MolWt: | 407.43 | Num_heavy_atoms: | 29 |
| TPSA: | 143.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD10055
Formula: C13H16O2N5
Smiles:
CCOC(=O)C1CCCN(c2ncnc3c2N=C[N]3)C1| HBA: | 7 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.54 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 274.3 | Num_heavy_atoms: | 20 |
| TPSA: | 81.78 | NumAromaticRings: | 1 |
