Glycoside
GD073186
Name:
NoneFormula:
C17H18O9N2Smiles:
O=C(NCc1cc(-c2ccc3c(c2)OCO3)no1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NCc1cc(-c2ccc3c(c2)OCO3)no1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -1.67 | Num_rotatable_bonds: | 8 |
| MolWt: | 394.34 | Num_heavy_atoms: | 28 |
| TPSA: | 171.58 | NumAromaticRings: | 2 |
Unique Aglycone
AD33978
Formula: C11H10O3N2
Smiles:
NCc1cc(-c2ccc3c(c2)OCO3)no1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.18 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 2 |
| MolWt: | 218.21 | Num_heavy_atoms: | 16 |
| TPSA: | 70.51 | NumAromaticRings: | 2 |
