Glycoside
GD001441
Name:
NoneFormula:
C22H31O4N7Smiles:
Nc1nc(-c2cnn(CCCC3CCCCC3)c2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(-c2cnn(CCCC3CCCCC3)c2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 7 |
| MolWt: | 457.54 | Num_heavy_atoms: | 33 |
| TPSA: | 157.36 | NumAromaticRings: | 3 |
Unique Aglycone
AD01449
Formula: C17H22N7
Smiles:
Nc1nc(-c2cnn(CCCC3CCCCC3)c2)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.53 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 324.41 | Num_heavy_atoms: | 24 |
| TPSA: | 96.08 | NumAromaticRings: | 2 |
