Glycoside
GD057822
Name:
NoneFormula:
C14H27O7N2Smiles:
COCCC1([NH3+])CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)CC1Aglycone:
COCCC1([NH3+])CCNCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.86 |
| AlogP: | -3.73 | Num_rotatable_bonds: | 8 |
| MolWt: | 335.38 | Num_heavy_atoms: | 23 |
| TPSA: | 155.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD29014
Formula: C8H19ON2
Smiles:
COCCC1([NH3+])CCNCC1| HBA: | 3 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 159.25 | Num_heavy_atoms: | 11 |
| TPSA: | 48.9 | NumAromaticRings: | 0 |
