Glycoside
GD067379
Name:
NoneFormula:
C16H21O6N3Smiles:
Cc1ncc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C#NAglycone:
Cc1ncc(C(=O)NCCO)cc1C#NSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -1.16 | Num_rotatable_bonds: | 5 |
| MolWt: | 351.36 | Num_heavy_atoms: | 25 |
| TPSA: | 144.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD32134
Formula: C10H11O2N3
Smiles:
Cc1ncc(C(=O)NCCO)cc1C#N| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | -0.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 205.22 | Num_heavy_atoms: | 15 |
| TPSA: | 86.01 | NumAromaticRings: | 1 |
