Glycoside

GD106584
Name:
NoneFormula:
C28H38O18SSmiles:
CC(=O)OC[C@@H]1O[C@@H](S[C@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=OAglycone:
COC(C)=O.COC(C)=OSugarmoiety:
CC(=O)OC1C(O)OC(SC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
HBA: | 18 | RingCount: | 2 |
HBD: | 0 | FractionCSP3: | 0.71 |
AlogP: | -0.11 | Num_rotatable_bonds: | 12 |
MolWt: | 694.66 | Num_heavy_atoms: | 47 |
TPSA: | 228.86 | NumAromaticRings: | 0 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=OHBA: | 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 |