Glycoside
GD024629
Name:
NoneFormula:
C27H28O5N2Smiles:
OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)c1nc(-c2ccccc2)c(-c2ccccc2)n1Cc1ccccc1Aglycone:
c1ccc(Cn2cnc(-c3ccccc3)c2-c2ccccc2)cc1Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.22 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 9 |
| MolWt: | 460.53 | Num_heavy_atoms: | 34 |
| TPSA: | 118.97 | NumAromaticRings: | 4 |
Unique Aglycone
AD16415
Formula: C22H18N2
Smiles:
c1ccc(Cn2cnc(-c3ccccc3)c2-c2ccccc2)cc1| HBA: | 2 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.05 |
| AlogP: | 5.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 310.4 | Num_heavy_atoms: | 24 |
| TPSA: | 17.82 | NumAromaticRings: | 4 |
