Glycoside
GD065519
Name:
NoneFormula:
C11H21O6N2BrSmiles:
OC[C@H]1O[C@@H](O)[C@H](NC2CCC(Br)CN2O)[C@@H](O)[C@@H]1OAglycone:
NC1CCC(Br)CN1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.05 | Num_rotatable_bonds: | 3 |
| MolWt: | 357.2 | Num_heavy_atoms: | 20 |
| TPSA: | 125.65 | NumAromaticRings: | 0 |
Unique Aglycone
AD31510
Formula: C5H11ON2Br
Smiles:
NC1CCC(Br)CN1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 0 |
| MolWt: | 195.06 | Num_heavy_atoms: | 9 |
| TPSA: | 49.49 | NumAromaticRings: | 0 |
