Glycoside
GD010793
Name:
NoneFormula:
C18H18O6N4Smiles:
Nc1ncnc2c1c(-c1ccc3c(c1)OCO3)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(c1ccc3c(c1)OCO3)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 386.36 | Num_heavy_atoms: | 28 |
| TPSA: | 145.11 | NumAromaticRings: | 3 |
Unique Aglycone
AD08290
Formula: C13H9O2N4
Smiles:
Nc1ncnc2c1C(c1ccc3c(c1)OCO3)=C[N]2| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.43 | Num_rotatable_bonds: | 1 |
| MolWt: | 253.24 | Num_heavy_atoms: | 19 |
| TPSA: | 84.36 | NumAromaticRings: | 2 |
