Glycoside

GD131759
Name:
NoneFormula:
C12H18O7N2Smiles:
COc1ccc(NC2OC(CO)C(O)C2O)c([NH+]([O-])O)c1Aglycone:
COc1ccc(N)c([NH+]([O-])O)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 9 | RingCount: | 2 |
HBD: | 6 | FractionCSP3: | 0.5 |
AlogP: | -2.05 | Num_rotatable_bonds: | 5 |
MolWt: | 302.28 | Num_heavy_atoms: | 21 |
TPSA: | 138.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD53367
Formula: C7H10O3N2
Smiles:
COc1ccc(N)c([NH+]([O-])O)c1HBA: | 5 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.14 |
AlogP: | -0.32 | Num_rotatable_bonds: | 2 |
MolWt: | 170.17 | Num_heavy_atoms: | 12 |
TPSA: | 82.98 | NumAromaticRings: | 1 |