Glycoside
GD010627
Name:
NoneFormula:
C16H20O6N4Br2Smiles:
Cc1nnc([C@@H](OCC=CBr)[C@@H](O)[C@@H](O)[C@@H](OCC=CBr)c2nnc(C)o2)o1Aglycone:
Cc1nnco1.Cc1nnco1Sugarmoiety:
CO.OC(OCC=CBr)C(O)C(O)OOCC=CBrOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.42 | Num_rotatable_bonds: | 11 |
| MolWt: | 524.17 | Num_heavy_atoms: | 28 |
| TPSA: | 136.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD05575
Formula: C3H4ON2
Smiles:
Cc1nnco1| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 0 |
| MolWt: | 84.08 | Num_heavy_atoms: | 6 |
| TPSA: | 38.92 | NumAromaticRings: | 1 |
