Glycoside
GD101232
Name:
NoneFormula:
C22H25O6N5Smiles:
O=C(c1cccc(Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1)N1CCOCC1Aglycone:
O=C(c1cccc(Nc2ncnc3c2C=C[N]3)c1)N1CCOCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 455.47 | Num_heavy_atoms: | 33 |
| TPSA: | 142.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD42813
Formula: C17H16O2N5
Smiles:
O=C(c1cccc(Nc2ncnc3c2C=C[N]3)c1)N1CCOCC1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 3 |
| MolWt: | 322.35 | Num_heavy_atoms: | 24 |
| TPSA: | 81.45 | NumAromaticRings: | 2 |
