Glycoside
...
GD150323

Name:
{6-[3-(3,4-dihydroxyphenyl)-2,3-dihydroxypropoxy]-3,4,5-trihydroxyoxan-2-yl}methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

Formula:
C25H30O13

Smiles:
COc1cc(C=CC(=O)OCC2OC(OCC(O)C(O)c3ccc(O)c(O)c3)C(O)C(O)C2O)ccc1O

Aglycone:
COC(=O)C=Cc1ccc(O)c(OC)c1.OCC(O)C(O)c1ccc(O)c(O)c1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 8 FractionCSP3: 0.4
AlogP: -0.71 Num_rotatable_bonds: 10
MolWt: 538.5 Num_heavy_atoms: 38
TPSA: 215.83 NumAromaticRings: 2

Unique Aglycone
AD00132
Formula: C11H12O4

Smiles:
COC(=O)C=Cc1ccc(O)c(OC)c1
HBA: 4 RingCount: 1
HBD: 1 FractionCSP3: 0.18
AlogP: 1.59 Num_rotatable_bonds: 3
MolWt: 208.21 Num_heavy_atoms: 15
TPSA: 55.76 NumAromaticRings: 1
AD60057
Formula: C9H12O5

Smiles:
OCC(O)C(O)c1ccc(O)c(O)c1
HBA: 5 RingCount: 1
HBD: 5 FractionCSP3: 0.33
AlogP: -0.52 Num_rotatable_bonds: 3
MolWt: 200.19 Num_heavy_atoms: 14
TPSA: 101.15 NumAromaticRings: 1

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O