Glycoside
GD077678
Name:
NoneFormula:
C19H20O5N4Smiles:
OC[C@H]1O[C@@H](n2cnc3c(Oc4ccc5c(c4)CCC5)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2Oc2ccc3c(c2)CCC3)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 384.39 | Num_heavy_atoms: | 28 |
| TPSA: | 122.75 | NumAromaticRings: | 3 |
Unique Aglycone
AD35558
Formula: C14H11ON4
Smiles:
C1=Nc2c(ncnc2Oc2ccc3c(c2)CCC3)[N]1| HBA: | 5 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.21 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 251.27 | Num_heavy_atoms: | 19 |
| TPSA: | 61.47 | NumAromaticRings: | 2 |
