Glycoside
GD077108
Name:
NoneFormula:
C18H27O5N5Smiles:
C[C@H]1CC[C@@](O)(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CC1Aglycone:
CC1CCC(O)(CNc2ncnc3c2N=C[N]3)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.72 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 393.44 | Num_heavy_atoms: | 28 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD35417
Formula: C13H18ON5
Smiles:
CC1CCC(O)(CNc2ncnc3c2N=C[N]3)CC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 3 |
| MolWt: | 260.32 | Num_heavy_atoms: | 19 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
