Glycoside
...
GD112202

Name:
[3-(acetyloxy)-6-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4,5-bis(prop-1-en-2-yloxy)oxan-2-yl]methyl acetate

Formula:
C25H32O9S

Smiles:
C=C(C)O[C@@H]1[C@@H](OC(=C)C)[C@H](SCC(=O)c2ccc(OC)cc2)O[C@H](COC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.COc1ccc(C(=O)CS)cc1

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

Other Identifiers

Properties
HBA: 9 RingCount: 2
HBD: 0 FractionCSP3: 0.48
AlogP: 3.67 Num_rotatable_bonds: 12
MolWt: 508.59 Num_heavy_atoms: 35
TPSA: 106.59 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
AD44366
Formula: C9H10O2S

Smiles:
COc1ccc(C(=O)CS)cc1
HBA: 2 RingCount: 1
HBD: 0 FractionCSP3: 0.22
AlogP: 1.81 Num_rotatable_bonds: 3
MolWt: 182.24 Num_heavy_atoms: 12
TPSA: 26.3 NumAromaticRings: 1

Sugarmoiety
SD04260

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