Glycoside
GD147388
Name:
Kwansonine AFormula:
C16H26O11N2Smiles:
O=C(O)C(CC(O)C(O)=NC1OCC=C1CO)NCC1(O)OCC(O)C(O)C1OAglycone:
CNC(CC(O)C(O)=NC1OCC=C1CO)C(=O)OSugarmoiety:
OC1COC(O)(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.75 |
| AlogP: | -4.19 | Num_rotatable_bonds: | 9 |
| MolWt: | 422.39 | Num_heavy_atoms: | 29 |
| TPSA: | 221.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD59028
Formula: C11H18O6N2
Smiles:
CNC(CC(O)C(O)=NC1OCC=C1CO)C(=O)O| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -1.36 | Num_rotatable_bonds: | 7 |
| MolWt: | 274.27 | Num_heavy_atoms: | 19 |
| TPSA: | 131.61 | NumAromaticRings: | 0 |
