Glycoside
GD081291
Name:
NoneFormula:
C17H28O9N2Smiles:
CNC(=O)CO[C@@H]1COC2(CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC2)C1Aglycone:
CNC(=O)COC1COC2(CCNCC2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.82 |
| AlogP: | -3.46 | Num_rotatable_bonds: | 8 |
| MolWt: | 404.42 | Num_heavy_atoms: | 28 |
| TPSA: | 165.86 | NumAromaticRings: | 0 |
Unique Aglycone
AD36641
Formula: C11H20O3N2
Smiles:
CNC(=O)COC1COC2(CCNCC2)C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.91 |
| AlogP: | -0.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 228.29 | Num_heavy_atoms: | 16 |
| TPSA: | 59.59 | NumAromaticRings: | 0 |
