Glycoside
GD066362
Name:
NoneFormula:
C16H21O6N3Smiles:
Cc1ccn2cc(CN(C)C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)nc2c1Aglycone:
CNCc1cn2ccc(C)cc2n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -1.75 | Num_rotatable_bonds: | 7 |
| MolWt: | 351.36 | Num_heavy_atoms: | 25 |
| TPSA: | 135.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD31800
Formula: C10H13N3
Smiles:
CNCc1cn2ccc(C)cc2n1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.3 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 175.23 | Num_heavy_atoms: | 13 |
| TPSA: | 29.33 | NumAromaticRings: | 2 |
