Glycoside
GD051875
Name:
NoneFormula:
C14H22O6N2Smiles:
O=C(c1nnc(CC2CCCCC2)o1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1nnc(CC2CCCCC2)o1Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 7 |
| MolWt: | 314.34 | Num_heavy_atoms: | 22 |
| TPSA: | 136.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD27035
Formula: C9H14ON2
Smiles:
c1nnc(CC2CCCCC2)o1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.78 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 166.22 | Num_heavy_atoms: | 12 |
| TPSA: | 38.92 | NumAromaticRings: | 1 |
