Glycoside

GD151534
Name:
{3,4,5-trihydroxy-6-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]oxan-2-yl}methyl acetateFormula:
C23H22O10Smiles:
CC(=O)OCC1OC(Oc2cc(O)c3c(=O)cc(-c4ccccc4)oc3c2)C(O)C(O)C1OAglycone:
COC(C)=O.O=c1cc(-c2ccccc2)oc2cc(O)cc(O)c12Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 4 |
HBD: | 4 | FractionCSP3: | 0.3 |
AlogP: | 0.92 | Num_rotatable_bonds: | 5 |
MolWt: | 458.42 | Num_heavy_atoms: | 33 |
TPSA: | 155.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=OHBA: | 2 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.67 |
AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
MolWt: | 74.08 | Num_heavy_atoms: | 5 |
TPSA: | 26.3 | NumAromaticRings: | 0 |
AD21411
Formula: C15H10O4
Smiles:
O=c1cc(-c2ccccc2)oc2cc(O)cc(O)c12HBA: | 4 | RingCount: | 3 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | 2.87 | Num_rotatable_bonds: | 1 |
MolWt: | 254.24 | Num_heavy_atoms: | 19 |
TPSA: | 70.67 | NumAromaticRings: | 3 |