Albiflorin

CAT: 0931-T6S1653-02Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0931-T6S1653-02Size:5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

39011-90-0

Target

ROS, Reactive Oxygen Species

Related Pathways

Immunology/Inflammation, Metabolism, NF-κB

Purity

0.9987

Bioactivity

1. Albiflorin (Alibiflorin) has anticonvulsant effect for pain relief. 2. Albiflorin and paeoniflorin has neuroprotective action against Glu toxicity. 3. Albiflorin and paeoniflorin significantly ameliorated Glu-induced reduction of cell viability, nuclear and mitochondrial apoptotic alteration, reactive oxygen species accumulation and B-cell lymphoma 2 (Bcl-2) /Bax ratio. 4. Albiflorin can serve as a new chemical marker for the quality control of Paeoniae Radix and the Chinese Pharmacopoeia can be updated, via has similar anti-inflammatory effects to paeoniflorin.

Smiles

C[C@]12C[C@@H](O)[C@@H]3C[C@@]1(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@]3(COC(=O)c1ccccc1)C(=O)O2

Molecular Formula

C23H28O11

Molecular Weight

480.46

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Albiflorin

Albiflorin is a monoterpene glycoside with formula C23H28O11, originally isolated from the roots of Paeonia lactiflora. It has a role as a neuroprotective agent and a plant metabolite. It is a beta-D-glucoside, a secondary alcohol, a bridged compound, a benzoate ester, a gamma-lactone and a monoterpene glycoside.

CAS Number	39011-90-0
PubChem CID	24868421
IUPAC Name	[(1R,3R,4R,6S,9S)-4-hydroxy-6-methyl-8-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-oxatricyclo[4.3.0.03,9]nonan-9-yl]methyl benzoate
Molecular Formula	C23H28O11
Molecular Weight	480.5
XLogP	-1
Topological Polar Surface Area	172
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	7
Heavy Atom Count	34
Formal Charge	0
Complexity	830

SMILES

C[C@]12C[C@H]([C@@H]3C[C@]1([C@@]3(C(=O)O2)COC(=O)C4=CC=CC=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O

InChI

InChI=1S/C23H28O11/c1-21-8-13(25)12-7-23(21,33-19-17(28)16(27)15(26)14(9-24)32-19)22(12,20(30)34-21)10-31-18(29)11-5-3-2-4-6-11/h2-6,12-17,19,24-28H,7-10H2,1H3/t12-,13+,14+,15+,16-,17+,19-,21-,22-,23-/m0/s1

InChIKey

QQUHMASGPODSIW-ICECTASOSA-N

Chemical Structure

2D Structure

CAS: 39011-90-0

CID: 24868421

Formula: C23H28O11

MW: 480.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	480.5
XLogP3	-1
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	7
Exact Mass	480.16316171
Monoisotopic Mass	480.16316171
Topological Polar Surface Area	172 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	830
Isotope Atom Count	0
Defined Atom Stereocenter Count	10
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
HY-N0037-01	Albiflorin
371149	Albiflorin discontinued
HY-N0037R-01	Albiflorin (Standard)

Albiflorin

Chemical Information

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