Glycoside
GD075120
Name:
NoneFormula:
C18H21O7N3Smiles:
COc1ccccc1-c1ncc(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cn1Aglycone:
COc1ccccc1-c1ncc(C(N)=O)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -1.32 | Num_rotatable_bonds: | 5 |
| MolWt: | 391.38 | Num_heavy_atoms: | 28 |
| TPSA: | 154.26 | NumAromaticRings: | 2 |
Unique Aglycone
AD34779
Formula: C12H11O2N3
Smiles:
COc1ccccc1-c1ncc(C(N)=O)cn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 229.24 | Num_heavy_atoms: | 17 |
| TPSA: | 78.1 | NumAromaticRings: | 2 |
