Glycoside
GD103267
Name:
NoneFormula:
C19H24O8NBrSmiles:
COc1cc(Br)cc2c1OCC(C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O)=C2Aglycone:
COc1cc(Br)cc2c1OCC(C(=O)NCCO)=C2Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 6 |
| MolWt: | 474.3 | Num_heavy_atoms: | 29 |
| TPSA: | 126.71 | NumAromaticRings: | 1 |
Unique Aglycone
AD43697
Formula: C13H14O4NBr
Smiles:
COc1cc(Br)cc2c1OCC(C(=O)NCCO)=C2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.16 | Num_heavy_atoms: | 19 |
| TPSA: | 67.79 | NumAromaticRings: | 1 |
