Glycoside
GD056932
Name:
NoneFormula:
C13H22O7N4Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(CO)nn2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
OCCn1cc(CO)nn1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.77 |
| AlogP: | -3.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 346.34 | Num_heavy_atoms: | 24 |
| TPSA: | 159.19 | NumAromaticRings: | 1 |
Unique Aglycone
AD26076
Formula: C5H9O2N3
Smiles:
OCCn1cc(CO)nn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 3 |
| MolWt: | 143.15 | Num_heavy_atoms: | 10 |
| TPSA: | 71.17 | NumAromaticRings: | 1 |
