Glycoside
GD000173
Name:
NoneFormula:
C13H15O5N2ClSmiles:
OCC(O)C(O)C(O)C(O)c1nc2cc(Cl)ccc2[nH]1Aglycone:
Clc1ccc2[nH]cnc2c1Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 302.71 | Num_heavy_atoms: | 20 |
| TPSA: | 129.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD00210
Formula: C8H5N2Cl
Smiles:
Clc1ccc2[nH]cnc2c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 0 |
| MolWt: | 152.58 | Num_heavy_atoms: | 10 |
| TPSA: | 28.68 | NumAromaticRings: | 2 |
