Glycoside
GD033124
Name:
NoneFormula:
C13H25O6N3Smiles:
CCCCn1cc(COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)nn1Aglycone:
CCCCn1cc(C)nn1Sugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.85 |
| AlogP: | -1.97 | Num_rotatable_bonds: | 11 |
| MolWt: | 319.36 | Num_heavy_atoms: | 22 |
| TPSA: | 141.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD21170
Formula: C7H13N3
Smiles:
CCCCn1cc(C)nn1| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.71 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 139.2 | Num_heavy_atoms: | 10 |
| TPSA: | 30.71 | NumAromaticRings: | 1 |
