Glycoside
GD017790
Name:
NoneFormula:
C17H21O4N4ClSmiles:
OC[C@@H]1O[C@H](n2cnc3c(NC4CCCC4)cc(Cl)nc32)[C@H](O)[C@H]1OAglycone:
Clc1cc(NC2CCCC2)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 368.82 | Num_heavy_atoms: | 25 |
| TPSA: | 112.66 | NumAromaticRings: | 2 |
Unique Aglycone
AD12656
Formula: C12H12N4Cl
Smiles:
Clc1cc(NC2CCCC2)c2c(n1)[N]C=N2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 3.0 | Num_rotatable_bonds: | 2 |
| MolWt: | 235.7 | Num_heavy_atoms: | 16 |
| TPSA: | 51.38 | NumAromaticRings: | 1 |
