Glycoside
GD056176
Name:
NoneFormula:
C13H20O8N2Smiles:
COc1cc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)on1Aglycone:
COc1cc(C(=O)NCCO)on1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -1.74 | Num_rotatable_bonds: | 6 |
| MolWt: | 332.31 | Num_heavy_atoms: | 23 |
| TPSA: | 143.51 | NumAromaticRings: | 1 |
Unique Aglycone
AD28248
Formula: C7H10O4N2
Smiles:
COc1cc(C(=O)NCCO)on1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 4 |
| MolWt: | 186.17 | Num_heavy_atoms: | 13 |
| TPSA: | 84.59 | NumAromaticRings: | 1 |
