Glycoside
GD102145
Name:
NoneFormula:
C20H21O8N2BrSmiles:
CCOC(=O)c1cccc(-c2ccc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(Br)n2)c1Aglycone:
CCOC(=O)c1cccc(-c2ccc(N)c(Br)n2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 9 |
| MolWt: | 497.3 | Num_heavy_atoms: | 31 |
| TPSA: | 166.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD43226
Formula: C14H13O2N2Br
Smiles:
CCOC(=O)c1cccc(-c2ccc(N)c(Br)n2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.17 | Num_heavy_atoms: | 19 |
| TPSA: | 65.21 | NumAromaticRings: | 2 |
