Glycoside
GD005185
Name:
NoneFormula:
C26H23O5N2ClSmiles:
OC[C@@H]1O[C@H](c2ccc(Cl)c(Cc3ccc(C#Cc4ccccc4)nn3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1ccccc1Cc1ccc(C#Cc2ccccc2)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.28 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 4 |
| MolWt: | 466.92 | Num_heavy_atoms: | 33 |
| TPSA: | 115.93 | NumAromaticRings: | 3 |
Unique Aglycone
AD04430
Formula: C20H13N2Cl
Smiles:
Clc1ccccc1Cc1ccc(C#Cc2ccccc2)nn1| HBA: | 2 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.05 |
| AlogP: | 4.12 | Num_rotatable_bonds: | 2 |
| MolWt: | 304.78 | Num_heavy_atoms: | 22 |
| TPSA: | 25.78 | NumAromaticRings: | 3 |
