Glycoside
GD021414
Name:
NoneFormula:
C30H39O5N7Smiles:
CC(C)(C)c1ccc(-c2nc3c(N4CCN(Cc5cn([C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)nn5)CC4)cccc3[nH]2)cc1Aglycone:
CC(C)(C)c1ccc(-c2nc3c(N4CCN(CC5=C[N]N=N5)CC4)cccc3[nH]2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 6 |
| MolWt: | 577.69 | Num_heavy_atoms: | 42 |
| TPSA: | 156.02 | NumAromaticRings: | 4 |
Unique Aglycone
AD14647
Formula: C24H28N7
Smiles:
CC(C)(C)c1ccc(-c2nc3c(N4CCN(CC5=C[N]N=N5)CC4)cccc3[nH]2)cc1| HBA: | 7 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 4.48 | Num_rotatable_bonds: | 4 |
| MolWt: | 414.54 | Num_heavy_atoms: | 31 |
| TPSA: | 73.98 | NumAromaticRings: | 3 |
