Glycoside
GD043100
Name:
NoneFormula:
C12H17O5N3Smiles:
O=c1nc(NC2CC2)ccn1[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1OAglycone:
O=c1nc(NC2CC2)cc[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 4 |
| MolWt: | 283.28 | Num_heavy_atoms: | 20 |
| TPSA: | 116.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD24878
Formula: C7H9ON3
Smiles:
O=c1nc(NC2CC2)cc[nH]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 151.17 | Num_heavy_atoms: | 11 |
| TPSA: | 57.78 | NumAromaticRings: | 1 |
