Glycoside
GD008319
Name:
NoneFormula:
C28H24O7N4Cl2Smiles:
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(OC4OC(CO)C(O)C(O)C4O)cc3)nc21Aglycone:
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(O)cc3)nc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 6 |
| MolWt: | 575.41 | Num_heavy_atoms: | 39 |
| TPSA: | 159.19 | NumAromaticRings: | 4 |
Unique Aglycone
AD06656
Formula: C22H14O2N4Cl2
Smiles:
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(O)cc3)nc21| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 4.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 413.26 | Num_heavy_atoms: | 28 |
| TPSA: | 80.04 | NumAromaticRings: | 4 |
