Glycoside

GD105005
Name:
NoneFormula:
C26H30O8Smiles:
O=C(O[C@H](CO)[C@H](OC(=O)c1ccccc1)[C@@H](O)[C@H]1COC2(CCCCC2)O1)c1ccccc1Aglycone:
C1CCC2(CC1)OCCO2.O=Cc1ccccc1.O=Cc1ccccc1Sugarmoiety:
OCC(OO)C(OO)C(O)OOther Identifiers
Properties
HBA: | 8 | RingCount: | 4 |
HBD: | 2 | FractionCSP3: | 0.46 |
AlogP: | 2.87 | Num_rotatable_bonds: | 8 |
MolWt: | 470.52 | Num_heavy_atoms: | 34 |
TPSA: | 111.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD01696
Formula: C7H6O
Smiles:
O=Cc1ccccc1HBA: | 1 | RingCount: | 1 |
HBD: | 0 | FractionCSP3: | 0.0 |
AlogP: | 1.5 | Num_rotatable_bonds: | 1 |
MolWt: | 106.12 | Num_heavy_atoms: | 8 |
TPSA: | 17.07 | NumAromaticRings: | 1 |
AD44033
Formula: C8H14O2
Smiles:
C1CCC2(CC1)OCCO2HBA: | 2 | RingCount: | 2 |
HBD: | 0 | FractionCSP3: | 1.0 |
AlogP: | 1.69 | Num_rotatable_bonds: | 0 |
MolWt: | 142.2 | Num_heavy_atoms: | 10 |
TPSA: | 18.46 | NumAromaticRings: | 0 |