Glycoside
GD056138
Name:
NoneFormula:
C14H22O8N2Smiles:
CN1C[C@]2(CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)C2)OCC1=OAglycone:
CN1CC2(CCNC2)OCC1=OSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | -3.91 | Num_rotatable_bonds: | 5 |
| MolWt: | 346.34 | Num_heavy_atoms: | 24 |
| TPSA: | 147.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD28212
Formula: C8H14O2N2
Smiles:
CN1CC2(CCNC2)OCC1=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.88 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 0 |
| MolWt: | 170.21 | Num_heavy_atoms: | 12 |
| TPSA: | 41.57 | NumAromaticRings: | 0 |
