Glycoside
GD114184
Name:
Perisaccharide BFormula:
C35H58O17Smiles:
COC1CC(OC2C(C)OC(OC3C(O)CC(OC4C(O)CC(OC5C(C)OC(=O)CC5OC)OC4C)OC3C)CC2OC)OC(C)C1OC(C)=OAglycone:
COC1CC(=O)OC(C)C1OSugarmoiety:
COC1CC(OC2C(C)OC(OC3C(O)CC(OC4C(O)CC(O)OC4C)OC3C)CC2OC)OC(C)C1OC(C)=OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.94 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 12 |
| MolWt: | 750.83 | Num_heavy_atoms: | 52 |
| TPSA: | 194.59 | NumAromaticRings: | 0 |
Unique Aglycone
AD44278
Formula: C7H12O4
Smiles:
COC1CC(=O)OC(C)C1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 160.17 | Num_heavy_atoms: | 11 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
