Glycoside
...
GD132694

Name:
4-[2-({6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-6-heptyl-4-hydroxybenzoyloxy]-2-heptyl-6-hydroxybenzoic acid

Formula:
C36H50O13

Smiles:
CCCCCCCc1cc(OC(=O)c2c(CCCCCCC)cc(O)cc2OC2OC(COC(C)=O)C(O)C(O)C2O)cc(O)c1C(=O)O

Aglycone:
CCCCCCCc1cc(OC(=O)c2c(O)cc(O)cc2CCCCCCC)cc(O)c1C(=O)O.COC(C)=O

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

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 6 FractionCSP3: 0.58
AlogP: 4.79 Num_rotatable_bonds: 19
MolWt: 690.78 Num_heavy_atoms: 49
TPSA: 209.51 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 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
AD18528
Formula: C28H38O7

Smiles:
CCCCCCCc1cc(OC(=O)c2c(O)cc(O)cc2CCCCCCC)cc(O)c1C(=O)O
HBA: 7 RingCount: 2
HBD: 4 FractionCSP3: 0.5
AlogP: 6.75 Num_rotatable_bonds: 15
MolWt: 486.61 Num_heavy_atoms: 35
TPSA: 124.29 NumAromaticRings: 2

Sugarmoiety
SD00017

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