Glycoside
...
GD130763

Name:
1-(4-{[2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxy}phenyl)methyl 4-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 2-(butan-2-yl)-2-hydroxybutanedioate

Formula:
C35H48O16

Smiles:
CCC(C)C(O)(CC(=O)OCc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1)C(=O)OCc1ccc(OC2CC(CO)C(O)C(O)C2O)cc1

Aglycone:
CCC(C)C(O)(CC(=O)OCc1ccc(O)cc1)C(=O)OCc1ccc(OC2CC(CO)C(O)C(O)C2O)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 4
HBD: 9 FractionCSP3: 0.6
AlogP: -1.34 Num_rotatable_bonds: 15
MolWt: 724.75 Num_heavy_atoms: 51
TPSA: 262.36 NumAromaticRings: 2

Unique Aglycone
AD52983
Formula: C29H38O11

Smiles:
CCC(C)C(O)(CC(=O)OCc1ccc(O)cc1)C(=O)OCc1ccc(OC2CC(CO)C(O)C(O)C2O)cc1
HBA: 11 RingCount: 3
HBD: 6 FractionCSP3: 0.52
AlogP: 1.19 Num_rotatable_bonds: 12
MolWt: 562.61 Num_heavy_atoms: 40
TPSA: 183.21 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O