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Chemical structure of 2-Acetylacteoside

GC35086

2-Acetylacteoside

Also listed as 2'-Acetylacteoside

2'-Acetylacteoside is a phenylethanoid glycoside isolated from Brandisia hancei, inhibits free radical-induced hemolysis of red blood cells and exhibits free radical scavenging activity

ChemicalCAS94492-24-7MW666.62FormulaC31H38O16
CAS number
94492-24-7
Molecular weight
666.62
Formula
C31H38O16
Solubility
DMSO ： 100 mg/mL (150·01 mM; Need ultrasonic)
InChIKey
ALERZNQPBWWLMW-OMRKUVHCSA-N
Catalogue number
GC35086
Brand
GLPBIO
Computed properties PubChem CID 21629996 · XLogP 0.1 · TPSA 251 Ų · H-bond donors 8
XLogP
0.1
TPSA
251 Ų
H-bond donors
8
H-bond acceptors
16
Rotatable bonds
13
Heavy atoms
47

SMILES C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H](O[C@H]([C@@H]2OC(=O)C)OCCC3=CC(=C(C=C3)O)O)CO)OC(=O)/C=C/C4=CC(=C(C=C4)O)O)O)O)O

Computed descriptors from PubChem (CID 21629996), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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