Glycoside
GD036489
Name:
NoneFormula:
C13H16O6N4Smiles:
OC[C@@H]1O[C@H](Oc2nnn(-c3ccccc3)n2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1nnn(-c2ccccc2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -2.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 324.29 | Num_heavy_atoms: | 23 |
| TPSA: | 142.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD23004
Formula: C7H6ON4
Smiles:
Oc1nnn(-c2ccccc2)n1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 1 |
| MolWt: | 162.15 | Num_heavy_atoms: | 12 |
| TPSA: | 63.83 | NumAromaticRings: | 2 |
