Glycoside
GD088353
Name:
NoneFormula:
C19H24O7N3ClSmiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)C1CCN(C(=O)c2cc(Cl)ccn2)CC1Aglycone:
NC(=O)C1CCN(C(=O)c2cc(Cl)ccn2)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -1.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 429.86 | Num_heavy_atoms: | 29 |
| TPSA: | 152.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD38651
Formula: C13H14O2N3Cl
Smiles:
NC(=O)C1CCN(C(=O)c2cc(Cl)ccn2)CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 267.72 | Num_heavy_atoms: | 18 |
| TPSA: | 76.29 | NumAromaticRings: | 1 |
