Glycoside
GD088771
Name:
NoneFormula:
C21H33O6N4Smiles:
O=C(c1cncc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1)N1CCC([NH+]2CCCC2)CC1Aglycone:
Nc1cncc(C(=O)N2CCC([NH+]3CCCC3)CC2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | -2.42 | Num_rotatable_bonds: | 5 |
| MolWt: | 437.52 | Num_heavy_atoms: | 31 |
| TPSA: | 139.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD38843
Formula: C15H23ON4
Smiles:
Nc1cncc(C(=O)N2CCC([NH+]3CCCC3)CC2)c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 2 |
| MolWt: | 275.38 | Num_heavy_atoms: | 20 |
| TPSA: | 63.66 | NumAromaticRings: | 1 |
