Glycoside
GD090706
Name:
NoneFormula:
C21H27O6N5Smiles:
Cc1cccc(C)c1OC[C@@H](O)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
Cc1cccc(C)c1OCC(O)CNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 8 |
| MolWt: | 445.48 | Num_heavy_atoms: | 32 |
| TPSA: | 155.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD39479
Formula: C16H18O2N5
Smiles:
Cc1cccc(C)c1OCC(O)CNc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 1.85 | Num_rotatable_bonds: | 6 |
| MolWt: | 312.35 | Num_heavy_atoms: | 23 |
| TPSA: | 93.73 | NumAromaticRings: | 2 |
