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Phlorin

CAT: 0804-HY-N3079-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N3079-01Size:1 mg
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Description
Phlorin (Phloroglucinol β-D-glucoside) is a phloroglucinol (PG) glucoside[1].
CAS Number
28217-60-9
Product Name Alternative
Phloroglucinol β-D-glucoside
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/phlorin.html
Solubility
10 mM in DMSO
Smiles
OC1=CC(O)=CC(O[C@H]2[C@@H]([C@H]([C@H](O)[C@@H](CO)O2)O)O)=C1
Molecular Formula
C12H16O8
Molecular Weight
288.25
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
References & Citations
[1]Salah E Abdel-Ghany, et al. Production of Phloroglucinol, a Platform Chemical, in Arabidopsis using a Bacterial Gene. Sci Rep. 2016 Dec 7:6:38483.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

3,5-Dihydroxyphenyl beta-D-glucopyranoside

(2S,3R,4S,5S,6R)-2-(3,5-dihydroxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol has been reported in Citrus reticulata, Sedum crassularia, and other organisms with data available.

CAS Number28217-60-9
PubChem CID476785
IUPAC Name(2S,3R,4S,5S,6R)-2-(3,5-dihydroxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular FormulaC12H16O8
Molecular Weight288.25
XLogP-1.2
Topological Polar Surface Area140
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity304
SMILES
C1=C(C=C(C=C1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O
InChI
InChI=1S/C12H16O8/c13-4-8-9(16)10(17)11(18)12(20-8)19-7-2-5(14)1-6(15)3-7/h1-3,8-18H,4H2/t8-,9-,10+,11-,12-/m1/s1
InChIKey
WXTPOHDTGNYFSB-RMPHRYRLSA-N
Chemical Structure
2D Structure
2D structure of 3,5-Dihydroxyphenyl beta-D-glucopyranoside
CAS: 28217-60-9
CID: 476785
Formula: C12H16O8
MW: 288.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight288.25
XLogP3-1.2
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass288.08451746
Monoisotopic Mass288.08451746
Topological Polar Surface Area140 Ų
Heavy Atom Count20
Formal Charge0
Complexity304
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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