Glycoside
...
GD009075

Name:
[3,4-bis(acetyloxy)-6-{2-[9-(acetyloxy)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-4-hydroxy-5-methylphenoxy}-5-hydroxyoxan-2-yl]methyl acetate

Formula:
C36H50O12

Smiles:
CC(=O)OCC1OC(Oc2cc(C)c(O)cc2CC=C(C)CCC=C(C)C[C@H](C=C(C)C)OC(C)=O)C(O)C(OC(C)=O)C1OC(C)=O

Aglycone:
CC(=O)OC(C=C(C)C)CC(C)=CCCC(C)=CCc1cc(O)c(C)cc1O.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(O)C1OC(C)=O

Other Identifiers

Properties
HBA: 12 RingCount: 2
HBD: 2 FractionCSP3: 0.56
AlogP: 5.1 Num_rotatable_bonds: 15
MolWt: 674.78 Num_heavy_atoms: 48
TPSA: 164.12 NumAromaticRings: 1

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
AD07160
Formula: C24H34O4

Smiles:
CC(=O)OC(C=C(C)C)CC(C)=CCCC(C)=CCc1cc(O)c(C)cc1O
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.46
AlogP: 5.91 Num_rotatable_bonds: 9
MolWt: 386.53 Num_heavy_atoms: 28
TPSA: 66.76 NumAromaticRings: 1

Sugarmoiety
SD00013

CC(=O)OC1C(O)OC(O)C(O)C1OC(C)=O