Glycoside
GD026401
Name:
NoneFormula:
C36H46O10N2Br2Smiles:
CCCCCCCC(c1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c2ccc(Br)cc12)c1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c2ccc(Br)cc12Aglycone:
CCCCCCCC(c1c[nH]c2ccc(Br)cc12)c1c[nH]c2ccc(Br)cc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.56 |
| AlogP: | 3.56 | Num_rotatable_bonds: | 12 |
| MolWt: | 826.58 | Num_heavy_atoms: | 50 |
| TPSA: | 190.16 | NumAromaticRings: | 4 |
Unique Aglycone
AD17406
Formula: C24H26N2Br2
Smiles:
CCCCCCCC(c1c[nH]c2ccc(Br)cc12)c1c[nH]c2ccc(Br)cc12| HBA: | 2 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 8.67 | Num_rotatable_bonds: | 8 |
| MolWt: | 502.29 | Num_heavy_atoms: | 28 |
| TPSA: | 31.58 | NumAromaticRings: | 4 |
