Glycoside
GD025163
Name:
NoneFormula:
C26H22O9N4Smiles:
NN1C(=O)c2c(c3c4cccc(O)c4n(C4OC(CO)C(O)C(O)C4O)c3c3[nH]c4c(O)cccc4c23)C1=OAglycone:
NN1C(=O)c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 7 |
| HBD: | 9 | FractionCSP3: | 0.23 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 534.48 | Num_heavy_atoms: | 39 |
| TPSA: | 214.73 | NumAromaticRings: | 5 |
Unique Aglycone
AD16716
Formula: C20H12O4N4
Smiles:
NN1C(=O)c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C1=O| HBA: | 8 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.0 |
| AlogP: | 2.84 | Num_rotatable_bonds: | 0 |
| MolWt: | 372.34 | Num_heavy_atoms: | 28 |
| TPSA: | 135.44 | NumAromaticRings: | 5 |
