Glycoside
GD036109
Name:
NoneFormula:
C19H20O5N2Smiles:
OC[C@@H]1O[C@H](c2nc(-c3ccc4ccccc4c3)c[nH]2)[C@H](O)[C@H](O)[C@H]1OAglycone:
c1ccc2cc(-c3c[nH]cn3)ccc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 3 |
| MolWt: | 356.38 | Num_heavy_atoms: | 26 |
| TPSA: | 118.83 | NumAromaticRings: | 3 |
Unique Aglycone
AD18443
Formula: C13H10N2
Smiles:
c1ccc2cc(-c3c[nH]cn3)ccc2c1| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 194.24 | Num_heavy_atoms: | 15 |
| TPSA: | 28.68 | NumAromaticRings: | 3 |
