Glycoside
GD051896
Name:
NoneFormula:
C13H20O6N2Smiles:
O[C@H]1[C@@H](O)[C@@H](c2nnc(CC3CCCC3)o2)O[C@@H](O)[C@@H]1OAglycone:
c1nnc(CC2CCCC2)o1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.85 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 3 |
| MolWt: | 300.31 | Num_heavy_atoms: | 21 |
| TPSA: | 129.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD27039
Formula: C8H12ON2
Smiles:
c1nnc(CC2CCCC2)o1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.75 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 152.2 | Num_heavy_atoms: | 11 |
| TPSA: | 38.92 | NumAromaticRings: | 1 |
