Glycoside

GD036087
Name:
NoneFormula:
C29H27O10ClSmiles:
O=C(COc1ccc(O[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@H](O)[C@H](O)[C@H]2O)c(CO)c1)c1ccc(Cl)cc1Aglycone:
COC(=O)c1ccccc1.O=C(COc1ccc(O)c(CO)c1)c1ccc(Cl)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 4 |
HBD: | 4 | FractionCSP3: | 0.29 |
AlogP: | 2.14 | Num_rotatable_bonds: | 10 |
MolWt: | 558.97 | Num_heavy_atoms: | 39 |
TPSA: | 151.98 | NumAromaticRings: | 3 |
Unique Aglycone
AD00480
Formula: C8H8O2
Smiles:
COC(=O)c1ccccc1HBA: | 2 | RingCount: | 1 |
HBD: | 0 | FractionCSP3: | 0.12 |
AlogP: | 1.47 | Num_rotatable_bonds: | 1 |
MolWt: | 136.15 | Num_heavy_atoms: | 10 |
TPSA: | 26.3 | NumAromaticRings: | 1 |
AD22795
Formula: C16H13O4Cl
Smiles:
O=C(COc1ccc(O)c(CO)c1)c1ccc(Cl)cc1HBA: | 4 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.13 |
AlogP: | 2.8 | Num_rotatable_bonds: | 5 |
MolWt: | 292.72 | Num_heavy_atoms: | 20 |
TPSA: | 66.76 | NumAromaticRings: | 2 |