Glycoside
GD048582
Name:
NoneFormula:
C14H18O6N2Smiles:
O=C(NC1(c2cccnc2)CC1)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
NC1(c2cccnc2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 7 |
| MolWt: | 310.31 | Num_heavy_atoms: | 22 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD25923
Formula: C8H10N2
Smiles:
NC1(c2cccnc2)CC1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 1 |
| MolWt: | 134.18 | Num_heavy_atoms: | 10 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
