Glycoside
...
GD115450

Name:
[5-(acetyloxy)-6-[2,6-bis(acetyloxy)-3-{3-[4-(acetyloxy)phenyl]prop-2-enoyl}phenyl]-3,4-dihydroxyoxan-2-yl]methyl acetate

Formula:
C31H32O14

Smiles:
CC(=O)OCC1OC(c2c(OC(C)=O)ccc(C(=O)C=Cc3ccc(OC(C)=O)cc3)c2OC(C)=O)C(OC(C)=O)C(O)C1O

Aglycone:
CC(=O)Oc1ccc(C=CC(=O)c2ccc(OC(C)=O)cc2OC(C)=O)cc1.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 2 FractionCSP3: 0.35
AlogP: 2.02 Num_rotatable_bonds: 10
MolWt: 628.58 Num_heavy_atoms: 45
TPSA: 198.26 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
AD45671
Formula: C21H18O7

Smiles:
CC(=O)Oc1ccc(C=CC(=O)c2ccc(OC(C)=O)cc2OC(C)=O)cc1
HBA: 7 RingCount: 2
HBD: 0 FractionCSP3: 0.14
AlogP: 3.36 Num_rotatable_bonds: 6
MolWt: 382.37 Num_heavy_atoms: 28
TPSA: 95.97 NumAromaticRings: 2

Sugarmoiety
SD00776

CC(=O)OC1C(O)OC(O)C(O)C1O