Glycoside
GD020582
Name:
NoneFormula:
C13H17O6N3Smiles:
NC(=O)c1ncn(C2O[C@H](CO)[C@H](O)[C@H]2O)c1C#CCCOAglycone:
NC(=O)C1=C(C#CCCO)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -2.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 311.29 | Num_heavy_atoms: | 22 |
| TPSA: | 151.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD14196
Formula: C8H8O2N3
Smiles:
NC(=O)C1=C(C#CCCO)[N]C=N1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 178.17 | Num_heavy_atoms: | 13 |
| TPSA: | 89.78 | NumAromaticRings: | 0 |
