Glycoside
GD059407
Name:
NoneFormula:
C15H22O6N2Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2cc(OCC3CC3)ccn2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc(OCC2CC2)ccn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.92 | Num_rotatable_bonds: | 6 |
| MolWt: | 326.35 | Num_heavy_atoms: | 23 |
| TPSA: | 124.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD29420
Formula: C9H12ON2
Smiles:
Nc1cc(OCC2CC2)ccn1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 164.21 | Num_heavy_atoms: | 12 |
| TPSA: | 48.14 | NumAromaticRings: | 1 |
