Glycoside
GD059333
Name:
NoneFormula:
C16H21O5N3Smiles:
OC[C@@H]1O[C@@H](n2c(N3CCOCC3)nc3ccccc32)[C@@H](O)[C@@H]1OAglycone:
c1ccc2c(c1)[N]C(N1CCOCC1)=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.56 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 335.36 | Num_heavy_atoms: | 24 |
| TPSA: | 100.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD29394
Formula: C11H12ON3
Smiles:
c1ccc2c(c1)[N]C(N1CCOCC1)=N2| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.36 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 0 |
| MolWt: | 202.24 | Num_heavy_atoms: | 15 |
| TPSA: | 38.93 | NumAromaticRings: | 1 |
