Glycoside
GD092165
Name:
NoneFormula:
C16H19O11N3Smiles:
COC(=O)c1c([N+](=O)[O-])ncn1[C@@H]1OC[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
COC(=O)C1=C([N+](=O)[O-])N=C[N]1Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.56 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 429.34 | Num_heavy_atoms: | 30 |
| TPSA: | 175.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD16717
Formula: C5H4O4N3
Smiles:
COC(=O)C1=C([N+](=O)[O-])N=C[N]1| HBA: | 7 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 170.1 | Num_heavy_atoms: | 12 |
| TPSA: | 95.9 | NumAromaticRings: | 0 |
