Glycoside
GD092569
Name:
NoneFormula:
C22H22O8N2Smiles:
Cc1ccccc1-n1c(C)nc2ccc(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)cc2c1=OAglycone:
Cc1ccccc1-n1c(C)nc2ccc(O)cc2c1=OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 442.42 | Num_heavy_atoms: | 32 |
| TPSA: | 151.34 | NumAromaticRings: | 3 |
Unique Aglycone
AD40348
Formula: C16H14O2N2
Smiles:
Cc1ccccc1-n1c(C)nc2ccc(O)cc2c1=O| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.71 | Num_rotatable_bonds: | 1 |
| MolWt: | 266.3 | Num_heavy_atoms: | 20 |
| TPSA: | 55.12 | NumAromaticRings: | 3 |
