Glycoside
GD017556
Name:
NoneFormula:
C18H23O5N5Smiles:
O=C(Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)[C@@H]1C[C@@H]2CC[C@H]1C2Aglycone:
O=C(Nc1ncnc2c1N=C[N]2)C1CC2CCC1C2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 389.41 | Num_heavy_atoms: | 28 |
| TPSA: | 142.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD12513
Formula: C13H14ON5
Smiles:
O=C(Nc1ncnc2c1N=C[N]2)C1CC2CCC1C2| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.54 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 2 |
| MolWt: | 256.29 | Num_heavy_atoms: | 19 |
| TPSA: | 81.34 | NumAromaticRings: | 1 |
