Glycoside
GD055101
Name:
NoneFormula:
C14H21O7N3Smiles:
Cc1nc([C@@H]2CCCCN2C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)no1Aglycone:
Cc1nc(C2CCCCN2)no1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -1.92 | Num_rotatable_bonds: | 6 |
| MolWt: | 343.34 | Num_heavy_atoms: | 24 |
| TPSA: | 157.22 | NumAromaticRings: | 1 |
Unique Aglycone
AD27970
Formula: C8H13ON3
Smiles:
Cc1nc(C2CCCCN2)no1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 1 |
| MolWt: | 167.21 | Num_heavy_atoms: | 12 |
| TPSA: | 50.95 | NumAromaticRings: | 1 |
