Glycoside
GD073841
Name:
NoneFormula:
C15H24O8N4Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(COC(C)=O)nn2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(=O)OCc1cn(CCO)nn1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 8 |
| MolWt: | 388.38 | Num_heavy_atoms: | 27 |
| TPSA: | 165.26 | NumAromaticRings: | 1 |
Unique Aglycone
AD28757
Formula: C7H11O3N3
Smiles:
CC(=O)OCc1cn(CCO)nn1| HBA: | 6 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.57 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 185.18 | Num_heavy_atoms: | 13 |
| TPSA: | 77.24 | NumAromaticRings: | 1 |
