Glycoside
GD103335
Name:
NoneFormula:
C18H23O7NClBrSmiles:
Cc1cc(Br)cc(Cl)c1OCC(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Cc1cc(Br)cc(Cl)c1OCC(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 7 |
| MolWt: | 468.73 | Num_heavy_atoms: | 27 |
| TPSA: | 117.48 | NumAromaticRings: | 1 |
Unique Aglycone
AD43736
Formula: C12H13O3NClBr
Smiles:
Cc1cc(Br)cc(Cl)c1OCC(=O)NCCO| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 322.59 | Num_heavy_atoms: | 17 |
| TPSA: | 58.56 | NumAromaticRings: | 1 |
