Glycoside
GD112564
Name:
NoneFormula:
C27H32O10N4Smiles:
CC(=O)OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](CNc1cc(C)c(C)cc1/N=N\c1ccc([N+](=O)[O-])cc1)OC(C)=OAglycone:
CNc1cc(C)c(C)cc1N=Nc1ccc([N+](=O)[O-])cc1Sugarmoiety:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(O)OC(C)=OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.41 |
| AlogP: | 4.4 | Num_rotatable_bonds: | 13 |
| MolWt: | 572.57 | Num_heavy_atoms: | 41 |
| TPSA: | 185.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD38269
Formula: C15H16O2N4
Smiles:
CNc1cc(C)c(C)cc1N=Nc1ccc([N+](=O)[O-])cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 4.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 284.32 | Num_heavy_atoms: | 21 |
| TPSA: | 79.89 | NumAromaticRings: | 2 |
