Glycoside
GD030729
Name:
NoneFormula:
C18H19O4N3Smiles:
OC[C@@H]1O[C@H](n2c3ccccc3c3c(C4CC4)ncnc32)[C@H](O)[C@H]1OAglycone:
c1ccc2c(c1)[N]c1ncnc(C3CC3)c1-2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 341.37 | Num_heavy_atoms: | 25 |
| TPSA: | 100.63 | NumAromaticRings: | 3 |
Unique Aglycone
AD19875
Formula: C13H10N3
Smiles:
c1ccc2c(c1)[N]c1ncnc(C3CC3)c1-2| HBA: | 3 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.23 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 1 |
| MolWt: | 208.24 | Num_heavy_atoms: | 16 |
| TPSA: | 39.88 | NumAromaticRings: | 2 |
