Glycoside
GD147004
Name:
His-RFormula:
C11H17O6N3Smiles:
NC(Cc1cn(C2OC(CO)C(O)C2O)cn1)C(=O)OAglycone:
NC(CC1=C[N]C=N1)C(=O)OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -2.55 | Num_rotatable_bonds: | 5 |
| MolWt: | 287.27 | Num_heavy_atoms: | 20 |
| TPSA: | 151.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD58890
Formula: C6H8O2N3
Smiles:
NC(CC1=C[N]C=N1)C(=O)O| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | -0.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 154.15 | Num_heavy_atoms: | 11 |
| TPSA: | 89.78 | NumAromaticRings: | 0 |
