Glycoside
GD017471
Name:
NoneFormula:
C10H9O4N2Cl2BrSmiles:
OC[C@@H]1O[C@H](n2c(Br)nc(Cl)c2Cl)[C@H](O)[C@H]1OAglycone:
ClC1=C(Cl)N=C(Br)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 347.98 | Num_heavy_atoms: | 17 |
| TPSA: | 87.74 | NumAromaticRings: | 1 |
Unique Aglycone
AD12004
Formula: C5N2Cl2Br
Smiles:
ClC1=C(Cl)N=C(Br)[N]1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 0 |
| MolWt: | 214.86 | Num_heavy_atoms: | 8 |
| TPSA: | 26.46 | NumAromaticRings: | 0 |
