Glycoside
GD051352
Name:
NoneFormula:
C15H23O5N2Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2ccc3c([nH+]2)CCCC3)[C@@H](O)[C@@H]1OAglycone:
Nc1ccc2c([nH+]1)CCCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.36 | Num_heavy_atoms: | 22 |
| TPSA: | 116.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD26851
Formula: C9H13N2
Smiles:
Nc1ccc2c([nH+]1)CCCC2| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 0 |
| MolWt: | 149.22 | Num_heavy_atoms: | 11 |
| TPSA: | 40.16 | NumAromaticRings: | 1 |
