Glycoside
GD057775
Name:
NoneFormula:
C15H24O5N3Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2cc(N3CCCC3)cc[nH+]2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc(N2CCCC2)cc[nH+]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 326.37 | Num_heavy_atoms: | 23 |
| TPSA: | 119.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD29000
Formula: C9H14N3
Smiles:
Nc1cc(N2CCCC2)cc[nH+]1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 1 |
| MolWt: | 164.23 | Num_heavy_atoms: | 12 |
| TPSA: | 43.4 | NumAromaticRings: | 1 |
