Glycoside
GD083461
Name:
NoneFormula:
C19H25O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4C[C@@]5(CCCO5)[C@@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N2CC3(CCCO3)C2C2CC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.74 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 403.44 | Num_heavy_atoms: | 29 |
| TPSA: | 125.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD37255
Formula: C14H16ON5
Smiles:
C1=Nc2c(ncnc2N2CC3(CCCO3)C2C2CC2)[N]1| HBA: | 6 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.64 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 2 |
| MolWt: | 270.32 | Num_heavy_atoms: | 20 |
| TPSA: | 64.71 | NumAromaticRings: | 1 |
