Glycoside
GD009266
Name:
NoneFormula:
C12H12O5N4Smiles:
N#C[C@@]1(c2ccc3c(O)ncnn23)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Oc1ncnn2cccc12Sugarmoiety:
N#CC1(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 2 |
| MolWt: | 292.25 | Num_heavy_atoms: | 21 |
| TPSA: | 144.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD07282
Formula: C6H5ON3
Smiles:
Oc1ncnn2cccc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 0 |
| MolWt: | 135.13 | Num_heavy_atoms: | 10 |
| TPSA: | 50.42 | NumAromaticRings: | 2 |
