Glycoside
...
GD035656

Name:
None

Formula:
C35H42O17

Smiles:
CC=C1[C@H](O[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)OC=C(C(=O)OC)[C@H]1CC(=O)OCCc1ccc2c(c1)OCCO2

Aglycone:
CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OCCc1ccc2c(c1)OCCO2.COC(C)=O

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

Other Identifiers

Properties
HBA: 17 RingCount: 4
HBD: 0 FractionCSP3: 0.54
AlogP: 2.01 Num_rotatable_bonds: 13
MolWt: 734.7 Num_heavy_atoms: 52
TPSA: 203.95 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
AD16718
Formula: C21H24O8

Smiles:
CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OCCc1ccc2c(c1)OCCO2
HBA: 8 RingCount: 3
HBD: 1 FractionCSP3: 0.43
AlogP: 1.9 Num_rotatable_bonds: 6
MolWt: 404.42 Num_heavy_atoms: 29
TPSA: 100.52 NumAromaticRings: 1

Sugarmoiety
SD00012

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