Glycoside
GD103729
Name:
NoneFormula:
C21H24O9N4Smiles:
CC(=O)OC[C@@H](OC(C)=O)[C@H](OC(C)=O)/C(=C/NNc1nc(=O)c2ccccc2[nH]1)OC(C)=OAglycone:
CNNc1nc(=O)c2ccccc2[nH]1Sugarmoiety:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(=O)OC(C)=OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 10 |
| MolWt: | 476.44 | Num_heavy_atoms: | 34 |
| TPSA: | 175.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD43864
Formula: C9H10ON4
Smiles:
CNNc1nc(=O)c2ccccc2[nH]1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 190.21 | Num_heavy_atoms: | 14 |
| TPSA: | 69.81 | NumAromaticRings: | 2 |
