Glycoside
GD066842
Name:
NoneFormula:
C15H20O6N4Smiles:
OC[C@H]1O[C@@](CO)(OCCn2cc(-c3cccnc3)nn2)[C@@H](O)[C@@H]1OAglycone:
OCCn1cc(-c2cccnc2)nn1Sugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -1.84 | Num_rotatable_bonds: | 7 |
| MolWt: | 352.35 | Num_heavy_atoms: | 25 |
| TPSA: | 142.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD31965
Formula: C9H10ON4
Smiles:
OCCn1cc(-c2cccnc2)nn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 190.21 | Num_heavy_atoms: | 14 |
| TPSA: | 63.83 | NumAromaticRings: | 2 |
