Glycoside
GD088513
Name:
NoneFormula:
C21H29O6N5Smiles:
CN(C)c1ncc(-c2cc(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)n(CC3CC3)c2)cn1Aglycone:
CN(C)c1ncc(-c2cc(C(N)=O)n(CC3CC3)c2)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 7 |
| MolWt: | 447.49 | Num_heavy_atoms: | 32 |
| TPSA: | 153.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD38720
Formula: C15H19ON5
Smiles:
CN(C)c1ncc(-c2cc(C(N)=O)n(CC3CC3)c2)cn1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 5 |
| MolWt: | 285.35 | Num_heavy_atoms: | 21 |
| TPSA: | 77.04 | NumAromaticRings: | 2 |
