Glycoside
GD106891
Name:
NoneFormula:
C26H36O15N2Smiles:
CCOC(=O)N1[C@H](C(=O)OC)C=C[C@@H](O[C@@H]2O[C@H](CC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)N1C(=O)OCCAglycone:
CCOC(=O)N1C(O)C=CC(C(=O)OC)N1C(=O)OCCSugarmoiety:
CC(=O)CC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.65 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 10 |
| MolWt: | 616.57 | Num_heavy_atoms: | 43 |
| TPSA: | 199.81 | NumAromaticRings: | 0 |
Unique Aglycone
AD44240
Formula: C12H18O7N2
Smiles:
CCOC(=O)N1C(O)C=CC(C(=O)OC)N1C(=O)OCC| HBA: | 9 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 302.28 | Num_heavy_atoms: | 21 |
| TPSA: | 105.61 | NumAromaticRings: | 0 |
