Glycoside
GD012884
Name:
NoneFormula:
C27H32O4N6Smiles:
OC[C@@H]1O[C@H](n2cnc3c(NCc4cccc5ccccc45)nc(NC4CCCCC4)nc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(nc(NC3CCCCC3)nc2NCc2cccc3ccccc23)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 2.95 | Num_rotatable_bonds: | 7 |
| MolWt: | 504.59 | Num_heavy_atoms: | 37 |
| TPSA: | 137.58 | NumAromaticRings: | 4 |
Unique Aglycone
AD09674
Formula: C22H23N6
Smiles:
C1=Nc2c(nc(NC3CCCCC3)nc2NCc2cccc3ccccc23)[N]1| HBA: | 6 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.32 |
| AlogP: | 4.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 371.47 | Num_heavy_atoms: | 28 |
| TPSA: | 76.3 | NumAromaticRings: | 3 |
