Glycoside
GD102070
Name:
NoneFormula:
C15H19O6NBr2Smiles:
CC(C)c1cc(Br)c(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)c(Br)c1Aglycone:
CC(C)c1cc(Br)c(N)c(Br)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 7 |
| MolWt: | 469.13 | Num_heavy_atoms: | 24 |
| TPSA: | 127.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD43207
Formula: C9H11NBr2
Smiles:
CC(C)c1cc(Br)c(N)c(Br)c1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 3.92 | Num_rotatable_bonds: | 1 |
| MolWt: | 293.0 | Num_heavy_atoms: | 12 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
