Glycoside
GD019228
Name:
NoneFormula:
C16H21O8N5Smiles:
COC(=O)CCNC(=O)c1cn(C2O[C@H](CO)[C@H](O)[C@H]2O)c2nc(N)nc(O)c12Aglycone:
COC(=O)CCNC(=O)C1=C[N]c2nc(N)nc(O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -2.38 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.37 | Num_heavy_atoms: | 29 |
| TPSA: | 202.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD13451
Formula: C11H12O4N5
Smiles:
COC(=O)CCNC(=O)C1=C[N]c2nc(N)nc(O)c21| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.27 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 4 |
| MolWt: | 278.25 | Num_heavy_atoms: | 20 |
| TPSA: | 141.53 | NumAromaticRings: | 1 |
