Glycoside
GD028208
Name:
NoneFormula:
C22H26O5N8Smiles:
CCCOc1ccc(-c2cn(-c3nc(NC)c4ncn([C@@H]5O[C@H](CO)[C@H](O)[C@H]5O)c4n3)nn2)cc1Aglycone:
CCCOc1ccc(-c2cn(-c3nc4c(c(NC)n3)N=C[N]4)nn2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 8 |
| MolWt: | 482.5 | Num_heavy_atoms: | 35 |
| TPSA: | 165.49 | NumAromaticRings: | 4 |
Unique Aglycone
AD18465
Formula: C17H17ON8
Smiles:
CCCOc1ccc(-c2cn(-c3nc4c(c(NC)n3)N=C[N]4)nn2)cc1| HBA: | 9 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 6 |
| MolWt: | 349.38 | Num_heavy_atoms: | 26 |
| TPSA: | 104.21 | NumAromaticRings: | 3 |
