Glycoside
GD005578
Name:
NoneFormula:
C16H19O6N3Smiles:
Cc1c(C(=O)OC[C@@H]2O[C@H](O)[C@H](O)[C@H]2O)nnn1Cc1ccccc1Aglycone:
COC(=O)c1nnn(Cc2ccccc2)c1CSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | -0.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 349.34 | Num_heavy_atoms: | 25 |
| TPSA: | 126.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD03803
Formula: C12H13O2N3
Smiles:
COC(=O)c1nnn(Cc2ccccc2)c1C| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 3 |
| MolWt: | 231.26 | Num_heavy_atoms: | 17 |
| TPSA: | 57.01 | NumAromaticRings: | 2 |
