Glycoside
GD051303
Name:
NoneFormula:
C15H24O5N2Smiles:
O=C(NC[C@H]1O[C@@H](CC(=O)N2CCCC2)[C@H](O)[C@@H]1O)C1CC1Aglycone:
CC(=O)N1CCCC1.CNC(=O)C1CC1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.87 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 5 |
| MolWt: | 312.37 | Num_heavy_atoms: | 22 |
| TPSA: | 99.1 | NumAromaticRings: | 0 |
Unique Aglycone
AD16348
Formula: C5H9ON
Smiles:
CNC(=O)C1CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 1 |
| MolWt: | 99.13 | Num_heavy_atoms: | 7 |
| TPSA: | 29.1 | NumAromaticRings: | 0 |
AD26841
Formula: C6H11ON
Smiles:
CC(=O)N1CCCC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.83 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 0 |
| MolWt: | 113.16 | Num_heavy_atoms: | 8 |
| TPSA: | 20.31 | NumAromaticRings: | 0 |
