Glycoside

GD076117
Name:
NoneFormula:
C17H23O6N4Smiles:
C#CCOC[C@H](O)CNc1[nH+]cnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
C#CCOCC(O)CNc1[nH+]cnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 3 |
HBD: | 6 | FractionCSP3: | 0.53 |
AlogP: | -2.12 | Num_rotatable_bonds: | 8 |
MolWt: | 379.39 | Num_heavy_atoms: | 27 |
TPSA: | 143.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD35178
Formula: C12H14O2N4
Smiles:
C#CCOCC(O)CNc1[nH+]cnc2c1C=C[N]2HBA: | 6 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.33 |
AlogP: | -0.46 | Num_rotatable_bonds: | 6 |
MolWt: | 246.27 | Num_heavy_atoms: | 18 |
TPSA: | 82.62 | NumAromaticRings: | 1 |