Glycoside
GD049057
Name:
NoneFormula:
C13H19O6N3Smiles:
CC/N=c1\ccc(N)cn1C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
CCN=c1ccc(N)c[nH]1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -2.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 313.31 | Num_heavy_atoms: | 22 |
| TPSA: | 158.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD26036
Formula: C7H11N3
Smiles:
CCN=c1ccc(N)c[nH]1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 1 |
| MolWt: | 137.19 | Num_heavy_atoms: | 10 |
| TPSA: | 54.17 | NumAromaticRings: | 1 |
