Glycoside
GD076815
Name:
NoneFormula:
C19H22O5N4Smiles:
O=c1nc(NCCc2c[nH]c3ccccc23)ccn1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1OAglycone:
O=c1nc(NCCc2c[nH]c3ccccc23)cc[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 386.41 | Num_heavy_atoms: | 28 |
| TPSA: | 132.63 | NumAromaticRings: | 3 |
Unique Aglycone
AD35312
Formula: C14H14ON4
Smiles:
O=c1nc(NCCc2c[nH]c3ccccc23)cc[nH]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 4 |
| MolWt: | 254.29 | Num_heavy_atoms: | 19 |
| TPSA: | 73.57 | NumAromaticRings: | 3 |
