Glycoside
GD004140
Name:
NoneFormula:
C14H21O4NSmiles:
Cc1cccc(CNC[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1Aglycone:
CNCc1cccc(C)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 5 |
| MolWt: | 267.33 | Num_heavy_atoms: | 19 |
| TPSA: | 81.95 | NumAromaticRings: | 1 |
Unique Aglycone
AD03659
Formula: C9H13N
Smiles:
CNCc1cccc(C)c1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 135.21 | Num_heavy_atoms: | 10 |
| TPSA: | 12.03 | NumAromaticRings: | 1 |
