Glycoside
GD098373
Name:
NoneFormula:
C21H29O8N3Smiles:
CC(C)(C)OC(=O)c1cccc(-c2cn(CCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)nn2)c1Aglycone:
CC(C)(C)OC(=O)c1cccc(-c2cn(CCO)nn2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 7 |
| MolWt: | 451.48 | Num_heavy_atoms: | 32 |
| TPSA: | 156.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD41819
Formula: C15H19O3N3
Smiles:
CC(C)(C)OC(=O)c1cccc(-c2cn(CCO)nn2)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 4 |
| MolWt: | 289.33 | Num_heavy_atoms: | 21 |
| TPSA: | 77.24 | NumAromaticRings: | 2 |
