Glycoside
GD131874
Name:
[3,4-bis(acetyloxy)-5-acetamido-6-{[3,4,5,6-tetrakis(acetyloxy)oxan-2-yl]methoxy}oxan-2-yl]methyl acetateFormula:
C28H39O18NSmiles:
CC(=O)OCC1OC(OCC2OC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(N=C(C)O)C(OC(C)=O)C1OC(C)=OAglycone:
COC(C)=OSugarmoiety:
CC(=O)OC1OC(COC2OC(O)C(OC(C)=O)C(OC(C)=O)C2N=C(C)O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.71 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 12 |
| MolWt: | 677.61 | Num_heavy_atoms: | 47 |
| TPSA: | 244.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.67 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
| MolWt: | 74.08 | Num_heavy_atoms: | 5 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
Sugarmoiety
SD07432
CC(=O)OC1OC(COC2OC(O)C(OC(C)=O)C(OC(C)=O)C2N=C(C)O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O