Glycoside
GD016577
Name:
NoneFormula:
C13H17O6N2BrSmiles:
O=C(NNC1OC(CO)C(O)C(O)C1O)c1cccc(Br)c1Aglycone:
NNC(=O)c1cccc(Br)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 377.19 | Num_heavy_atoms: | 22 |
| TPSA: | 131.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD11922
Formula: C7H7ON2Br
Smiles:
NNC(=O)c1cccc(Br)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 1 |
| MolWt: | 215.05 | Num_heavy_atoms: | 11 |
| TPSA: | 55.12 | NumAromaticRings: | 1 |
