Glycoside
GD054995
Name:
NoneFormula:
C16H22O6N2Smiles:
O=C(C(=O)N1CCC(c2ccccn2)CC1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
c1ccc(C2CCNCC2)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 6 |
| MolWt: | 338.36 | Num_heavy_atoms: | 24 |
| TPSA: | 131.19 | NumAromaticRings: | 1 |
Unique Aglycone
AD27918
Formula: C10H14N2
Smiles:
c1ccc(C2CCNCC2)nc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 1 |
| MolWt: | 162.24 | Num_heavy_atoms: | 12 |
| TPSA: | 24.92 | NumAromaticRings: | 1 |
