Glycoside
GD000208
Name:
NoneFormula:
C13H21O6N5Smiles:
CCCCNN=Nc1cn(C2OC(CO)C(O)C2O)c(=O)[nH]c1=OAglycone:
CCCCNN=Nc1c[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.46 | Num_rotatable_bonds: | 7 |
| MolWt: | 343.34 | Num_heavy_atoms: | 24 |
| TPSA: | 161.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD00243
Formula: C8H13O2N5
Smiles:
CCCCNN=Nc1c[nH]c(=O)[nH]c1=O| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 5 |
| MolWt: | 211.22 | Num_heavy_atoms: | 15 |
| TPSA: | 102.47 | NumAromaticRings: | 1 |
