Glycoside
GD091924
Name:
NoneFormula:
C21H23O6N5Smiles:
COC(=O)c1ccc2c(c1)CN(c1ncnc3c1ncn3[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)CC2Aglycone:
COC(=O)c1ccc2c(c1)CN(c1ncnc3c1N=C[N]3)CC2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 441.44 | Num_heavy_atoms: | 32 |
| TPSA: | 143.06 | NumAromaticRings: | 3 |
Unique Aglycone
AD40108
Formula: C16H14O2N5
Smiles:
COC(=O)c1ccc2c(c1)CN(c1ncnc3c1N=C[N]3)CC2| HBA: | 7 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 2 |
| MolWt: | 308.32 | Num_heavy_atoms: | 23 |
| TPSA: | 81.78 | NumAromaticRings: | 2 |
