Glycoside
...
GD139266

Name:
4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate

Formula:
C44H64O24

Smiles:
CC(C=CC=C(C)C(=O)OC1OC(CO)C(O)C(O)C1O)=CC=CC=C(C)C=CC=C(C)C(=O)OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O

Aglycone:
CC(C=CC=C(C)C(=O)O)=CC=CC=C(C)C=CC=C(C)C(=O)O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(OCC2OC(O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 24 RingCount: 4
HBD: 14 FractionCSP3: 0.64
AlogP: -5.23 Num_rotatable_bonds: 18
MolWt: 976.97 Num_heavy_atoms: 68
TPSA: 391.2 NumAromaticRings: 0

Unique Aglycone
AD08706
Formula: C20H24O4

Smiles:
CC(C=CC=C(C)C(=O)O)=CC=CC=C(C)C=CC=C(C)C(=O)O
HBA: 4 RingCount: 0
HBD: 2 FractionCSP3: 0.2
AlogP: 4.61 Num_rotatable_bonds: 8
MolWt: 328.41 Num_heavy_atoms: 24
TPSA: 74.6 NumAromaticRings: 0

Sugarmoiety
SD03349

OCC1OC(O)C(O)C(O)C1O.OCC1OC(OCC2OC(O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O