Glycoside
GD061296
Name:
NoneFormula:
C16H18O6N2Smiles:
O[C@H]1[C@@H](O)[C@@H](c2nnc([C@H]3C[C@H]3c3ccccc3)o2)O[C@@H](O)[C@@H]1OAglycone:
c1ccc(C2CC2c2nnco2)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 3 |
| MolWt: | 334.33 | Num_heavy_atoms: | 24 |
| TPSA: | 129.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD30096
Formula: C11H10ON2
Smiles:
c1ccc(C2CC2c2nnco2)cc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.27 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 186.21 | Num_heavy_atoms: | 14 |
| TPSA: | 38.92 | NumAromaticRings: | 2 |
