Glycoside
GD098658
Name:
NoneFormula:
C17H18O7N3BrSmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc(Oc2ncc(Br)cn2)cc1Aglycone:
NC(=O)c1ccc(Oc2ncc(Br)cn2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 456.25 | Num_heavy_atoms: | 28 |
| TPSA: | 154.26 | NumAromaticRings: | 2 |
Unique Aglycone
AD41964
Formula: C11H8O2N3Br
Smiles:
NC(=O)c1ccc(Oc2ncc(Br)cn2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 294.11 | Num_heavy_atoms: | 17 |
| TPSA: | 78.1 | NumAromaticRings: | 2 |
