Glycoside
GD059653
Name:
NoneFormula:
C15H25O6N3Smiles:
CC(C)n1nccc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CC(C)n1nccc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -0.96 | Num_rotatable_bonds: | 6 |
| MolWt: | 343.38 | Num_heavy_atoms: | 24 |
| TPSA: | 126.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD29529
Formula: C9H15O2N3
Smiles:
CC(C)n1nccc1C(=O)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 197.24 | Num_heavy_atoms: | 14 |
| TPSA: | 67.15 | NumAromaticRings: | 1 |
