Glycoside
GD105784
Name:
NoneFormula:
C28H39O19NSmiles:
CC(=O)OC[C@H]1O[C@@H](O[C@@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)C(N)=O)[C@@H](COC(C)=O)OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
COC(C)=OSugarmoiety:
CC(=O)OCC1OC(OC(C(O)OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(N)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.68 |
| AlogP: | -1.7 | Num_rotatable_bonds: | 16 |
| MolWt: | 693.61 | Num_heavy_atoms: | 48 |
| TPSA: | 271.95 | 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
SD04155
CC(=O)OCC1OC(OC(C(O)OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(N)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O