Glycoside
GD083434
Name:
NoneFormula:
C19H21O6N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NC[C@H]4COc5ccccc5O4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCC2COc3ccccc3O2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 415.41 | Num_heavy_atoms: | 30 |
| TPSA: | 144.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD37246
Formula: C14H12O2N5
Smiles:
C1=Nc2c(ncnc2NCC2COc3ccccc3O2)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 282.28 | Num_heavy_atoms: | 21 |
| TPSA: | 82.73 | NumAromaticRings: | 2 |
