Glycoside
GD083586
Name:
NoneFormula:
C18H23O8N3Smiles:
CC(C)(C)OC(=O)n1ncc2c(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)cccc21Aglycone:
CC(C)(C)OC(=O)n1ncc2c(N)cccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 6 |
| MolWt: | 409.4 | Num_heavy_atoms: | 29 |
| TPSA: | 171.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD37288
Formula: C12H15O2N3
Smiles:
CC(C)(C)OC(=O)n1ncc2c(N)cccc21| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 0 |
| MolWt: | 233.27 | Num_heavy_atoms: | 17 |
| TPSA: | 70.14 | NumAromaticRings: | 2 |
