Glycoside

GD028868
Name:
NoneFormula:
C41H72O24N12Smiles:
OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)COCc1cn(CC(Cn2cc(COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)nn2)(Cn2cc(COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)nn2)Cn2cc(COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)nn2)nn1Aglycone:
Cc1cn(CC(Cn2cc(C)nn2)(Cn2cc(C)nn2)Cn2cc(C)nn2)nn1Sugarmoiety:
OCC(O)C(O)C(O)C(O)COO.OCC(O)C(O)C(O)C(O)COO.OCC(O)C(O)C(O)C(O)COO.OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
HBA: | 36 | RingCount: | 4 |
HBD: | 20 | FractionCSP3: | 0.8 |
AlogP: | -13.05 | Num_rotatable_bonds: | 40 |
MolWt: | 1117.09 | Num_heavy_atoms: | 77 |
TPSA: | 564.36 | NumAromaticRings: | 4 |
Unique Aglycone
AD18822
Formula: C17H24N12
Smiles:
Cc1cn(CC(Cn2cc(C)nn2)(Cn2cc(C)nn2)Cn2cc(C)nn2)nn1HBA: | 12 | RingCount: | 4 |
HBD: | 0 | FractionCSP3: | 0.53 |
AlogP: | 0.37 | Num_rotatable_bonds: | 8 |
MolWt: | 396.46 | Num_heavy_atoms: | 29 |
TPSA: | 122.84 | NumAromaticRings: | 4 |
Sugarmoiety

SD02743
OCC(O)C(O)C(O)C(O)COO.OCC(O)C(O)C(O)C(O)COO.OCC(O)C(O)C(O)C(O)COO.OCC(O)C(O)C(O)C(O)COO