Glycoside
GD053747
Name:
NoneFormula:
C15H27O6N2Smiles:
C[N@H+]1CCC2(CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CC2)C1Aglycone:
C[NH+]1CCC2(CCNCC2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | -3.84 | Num_rotatable_bonds: | 5 |
| MolWt: | 331.39 | Num_heavy_atoms: | 23 |
| TPSA: | 122.74 | NumAromaticRings: | 0 |
Unique Aglycone
AD27397
Formula: C9H19N2
Smiles:
C[NH+]1CCC2(CCNCC2)C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 0 |
| MolWt: | 155.26 | Num_heavy_atoms: | 11 |
| TPSA: | 16.47 | NumAromaticRings: | 0 |
