Glycoside
GD050240
Name:
NoneFormula:
C14H25O6N2Smiles:
O=C(NCC12CC[NH+](CC1)CC2)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
NCC12CC[NH+](CC1)CC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.86 |
| AlogP: | -4.18 | Num_rotatable_bonds: | 7 |
| MolWt: | 317.36 | Num_heavy_atoms: | 22 |
| TPSA: | 131.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD26558
Formula: C8H17N2
Smiles:
NCC12CC[NH+](CC1)CC2| HBA: | 2 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 141.24 | Num_heavy_atoms: | 10 |
| TPSA: | 30.46 | NumAromaticRings: | 0 |
