Glycoside
GD095431
Name:
NoneFormula:
C21H35O8N5Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc([C@H]3CCN(C(=O)OC(C)(C)C)C3)nn2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCC(c2cn(CCO)nn2)C1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 485.54 | Num_heavy_atoms: | 34 |
| TPSA: | 168.5 | NumAromaticRings: | 1 |
Unique Aglycone
AD38807
Formula: C13H22O3N4
Smiles:
CC(C)(C)OC(=O)N1CCC(c2cn(CCO)nn2)C1| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.77 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 3 |
| MolWt: | 282.34 | Num_heavy_atoms: | 20 |
| TPSA: | 80.48 | NumAromaticRings: | 1 |
