Glycoside
GD056604
Name:
NoneFormula:
C15H23O5N3Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2ccc(N3CCCC3)nc2)[C@@H](O)[C@@H]1OAglycone:
Nc1ccc(N2CCCC2)nc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 325.36 | Num_heavy_atoms: | 23 |
| TPSA: | 118.31 | NumAromaticRings: | 1 |
Unique Aglycone
AD28448
Formula: C9H13N3
Smiles:
Nc1ccc(N2CCCC2)nc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 1 |
| MolWt: | 163.22 | Num_heavy_atoms: | 12 |
| TPSA: | 42.15 | NumAromaticRings: | 1 |
