Glycoside
GD026181
Name:
NoneFormula:
C25H23O7N2ClSmiles:
OC[C@@H]1O[C@H](c2ccc(Cl)c(Cc3ccc(-c4ccc5c(c4)OCO5)nn3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1ccccc1Cc1ccc(-c2ccc3c(c2)OCO3)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 5 |
| MolWt: | 486.91 | Num_heavy_atoms: | 34 |
| TPSA: | 134.39 | NumAromaticRings: | 3 |
Unique Aglycone
AD17277
Formula: C19H13O2N2Cl
Smiles:
Clc1ccccc1Cc1ccc(-c2ccc3c(c2)OCO3)nn1| HBA: | 4 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 4.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 324.77 | Num_heavy_atoms: | 23 |
| TPSA: | 44.24 | NumAromaticRings: | 3 |
