Glycoside
GD052796
Name:
NoneFormula:
C14H19O5N5Smiles:
OC[C@@H]1O[C@H](n2cnc3c(N4CCOCC4)ncnc32)[C@@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N2CCOCC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.64 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 3 |
| MolWt: | 337.34 | Num_heavy_atoms: | 24 |
| TPSA: | 125.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD09442
Formula: C9H10ON5
Smiles:
C1=Nc2c(ncnc2N2CCOCC2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.44 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 204.21 | Num_heavy_atoms: | 15 |
| TPSA: | 64.71 | NumAromaticRings: | 1 |
