Glycoside

GD136814
Name:
NoneFormula:
C25H22O17Smiles:
O=C(O)C(=O)OC(=O)C(=O)OCC1OC(OC2=Cc3c(O)cc(O)cc3OC2c2ccc(O)c(O)c2)C(O)C(O)C1OAglycone:
COC(=O)C(=O)OC(=O)C(=O)O.OC1=Cc2c(O)cc(O)cc2OC1c1ccc(O)c(O)c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 17 | RingCount: | 4 |
HBD: | 8 | FractionCSP3: | 0.28 |
AlogP: | -1.49 | Num_rotatable_bonds: | 5 |
MolWt: | 594.43 | Num_heavy_atoms: | 42 |
TPSA: | 276.27 | NumAromaticRings: | 2 |
Unique Aglycone
AD44975
Formula: C15H12O6
Smiles:
OC1=Cc2c(O)cc(O)cc2OC1c1ccc(O)c(O)c1HBA: | 6 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.07 |
AlogP: | 2.54 | Num_rotatable_bonds: | 1 |
MolWt: | 288.25 | Num_heavy_atoms: | 21 |
TPSA: | 110.38 | NumAromaticRings: | 2 |
AD55300
Formula: C5H4O7
Smiles:
COC(=O)C(=O)OC(=O)C(=O)OHBA: | 7 | RingCount: | 0 |
HBD: | 1 | FractionCSP3: | 0.2 |
AlogP: | -1.69 | Num_rotatable_bonds: | 0 |
MolWt: | 176.08 | Num_heavy_atoms: | 12 |
TPSA: | 106.97 | NumAromaticRings: | 0 |