Glycoside
GD047538
Name:
NoneFormula:
C14H18O6N3Smiles:
O=C(NCc1[nH]c[n+]2ccccc12)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NCc1[nH]c[n+]2ccccc12Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.36 |
| AlogP: | -2.99 | Num_rotatable_bonds: | 7 |
| MolWt: | 324.31 | Num_heavy_atoms: | 23 |
| TPSA: | 146.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD25546
Formula: C8H10N3
Smiles:
NCc1[nH]c[n+]2ccccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 148.19 | Num_heavy_atoms: | 11 |
| TPSA: | 45.91 | NumAromaticRings: | 2 |
