Glycoside
GD057785
Name:
NoneFormula:
C15H29O6N2Smiles:
CC[NH+](CC)C1CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CC1Aglycone:
CC[NH+](CC)C1CCNCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | -3.45 | Num_rotatable_bonds: | 8 |
| MolWt: | 333.41 | Num_heavy_atoms: | 23 |
| TPSA: | 122.74 | NumAromaticRings: | 0 |
Unique Aglycone
AD29006
Formula: C9H21N2
Smiles:
CC[NH+](CC)C1CCNCC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 157.28 | Num_heavy_atoms: | 11 |
| TPSA: | 16.47 | NumAromaticRings: | 0 |
