Glycoside
GD090942
Name:
NoneFormula:
C19H21O5N7Smiles:
O=c1[nH]c2ccccc2n1CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
O=c1[nH]c2ccccc2n1CCNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.81 | Num_rotatable_bonds: | 6 |
| MolWt: | 427.42 | Num_heavy_atoms: | 31 |
| TPSA: | 163.34 | NumAromaticRings: | 4 |
Unique Aglycone
AD39600
Formula: C14H12ON7
Smiles:
O=c1[nH]c2ccccc2n1CCNc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 294.3 | Num_heavy_atoms: | 22 |
| TPSA: | 102.06 | NumAromaticRings: | 3 |
