Glycoside
GD031493
Name:
NoneFormula:
C25H31O6BrSmiles:
CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c3c(c2Br)CCCC3)cc1Aglycone:
CCOc1ccc(Cc2ccc3c(c2Br)CCCC3)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 507.42 | Num_heavy_atoms: | 32 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD20283
Formula: C19H21OBr
Smiles:
CCOc1ccc(Cc2ccc3c(c2Br)CCCC3)cc1| HBA: | 1 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.37 |
| AlogP: | 5.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 345.28 | Num_heavy_atoms: | 21 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
