Glycoside

GD141874
Name:
Desmethylagrimonolide 6-O-Beta-D-GlucopyranosideFormula:
C23H26O10Smiles:
O=C1OC(CCc2ccc(O)cc2)Cc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c21Aglycone:
O=C1OC(CCc2ccc(O)cc2)Cc2cc(O)cc(O)c21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 4 |
HBD: | 6 | FractionCSP3: | 0.43 |
AlogP: | -0.01 | Num_rotatable_bonds: | 6 |
MolWt: | 462.45 | Num_heavy_atoms: | 33 |
TPSA: | 166.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD57121
Formula: C17H16O5
Smiles:
O=C1OC(CCc2ccc(O)cc2)Cc2cc(O)cc(O)c21HBA: | 5 | RingCount: | 3 |
HBD: | 3 | FractionCSP3: | 0.24 |
AlogP: | 2.52 | Num_rotatable_bonds: | 3 |
MolWt: | 300.31 | Num_heavy_atoms: | 22 |
TPSA: | 86.99 | NumAromaticRings: | 2 |