Glycoside
GD014943
Name:
NoneFormula:
C22H30O9N2Smiles:
CCN(CC)C(=O)[C@@]1(c2ccccc2)C[C@H]1CNC(=O)O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCN(CC)C(=O)C1(c2ccccc2)CC1CNC(=O)OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 8 |
| MolWt: | 466.49 | Num_heavy_atoms: | 33 |
| TPSA: | 165.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD10934
Formula: C16H22O3N2
Smiles:
CCN(CC)C(=O)C1(c2ccccc2)CC1CNC(=O)O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.08 | Num_rotatable_bonds: | 6 |
| MolWt: | 290.36 | Num_heavy_atoms: | 21 |
| TPSA: | 69.64 | NumAromaticRings: | 1 |
