Glycoside
GD076096
Name:
NoneFormula:
C19H25O6N3Smiles:
N#Cc1ccc(C(=O)N2CCC(N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)CC2)cc1Aglycone:
N#Cc1ccc(C(=O)N2CCC(N)CC2)cc1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 8 |
| MolWt: | 391.42 | Num_heavy_atoms: | 28 |
| TPSA: | 154.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD35171
Formula: C13H15ON3
Smiles:
N#Cc1ccc(C(=O)N2CCC(N)CC2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 229.28 | Num_heavy_atoms: | 17 |
| TPSA: | 70.12 | NumAromaticRings: | 1 |
