Glycoside
GD076681
Name:
NoneFormula:
C16H23O8N3Smiles:
CN(CCC[C@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)c1cccnc1)N=OAglycone:
CN(CCCC(O)c1cccnc1)N=OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.58 | Num_rotatable_bonds: | 9 |
| MolWt: | 385.37 | Num_heavy_atoms: | 27 |
| TPSA: | 162.01 | NumAromaticRings: | 1 |
Unique Aglycone
AD35298
Formula: C10H15O2N3
Smiles:
CN(CCCC(O)c1cccnc1)N=O| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 209.25 | Num_heavy_atoms: | 15 |
| TPSA: | 65.79 | NumAromaticRings: | 1 |
