Glycoside
GD010162
Name:
NoneFormula:
C18H25O7N3Smiles:
COCCCNC(=O)c1ccc2[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nc2c1Aglycone:
COCCCNC(=O)c1ccc2[nH]cnc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -1.16 | Num_rotatable_bonds: | 7 |
| MolWt: | 395.41 | Num_heavy_atoms: | 28 |
| TPSA: | 157.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD07888
Formula: C12H15O2N3
Smiles:
COCCCNC(=O)c1ccc2[nH]cnc2c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 5 |
| MolWt: | 233.27 | Num_heavy_atoms: | 17 |
| TPSA: | 67.01 | NumAromaticRings: | 2 |
