Glycoside
...
GD110358

Name:
ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-7-{[3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}-4H-chromene-2-carboxylate

Formula:
C34H34O16

Smiles:
CCOC(=O)c1oc2cc(O[C@@H]3O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3OC(C)=O)ccc2c(=O)c1-c1ccc2c(c1)OCCO2

Aglycone:
CCOC(=O)c1oc2cc(O)ccc2c(=O)c1-c1ccc2c(c1)OCCO2.COC(C)=O

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

Other Identifiers

Properties
HBA: 16 RingCount: 5
HBD: 0 FractionCSP3: 0.41
AlogP: 2.87 Num_rotatable_bonds: 10
MolWt: 698.63 Num_heavy_atoms: 50
TPSA: 198.63 NumAromaticRings: 3

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
AD44597
Formula: C20H16O7

Smiles:
CCOC(=O)c1oc2cc(O)ccc2c(=O)c1-c1ccc2c(c1)OCCO2
HBA: 7 RingCount: 4
HBD: 1 FractionCSP3: 0.2
AlogP: 3.11 Num_rotatable_bonds: 3
MolWt: 368.34 Num_heavy_atoms: 27
TPSA: 95.2 NumAromaticRings: 3

Sugarmoiety
SD00012

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