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Hemiphloin

CAT: 0013-GTR19164551-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19164551-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Hemiphloin is a naturally occurring flavonoid with demonstrated anti-inflammatory properties. It serves as a research tool for studying inflammatory pathways and shows potential as a therapeutic candidate for dermatological conditions, supported by both in vitro and in vivo experimental data.
CAS Number
71963-94-5
Product Name Alternative
Hemiphloin, Inhibitor, inhibit
Purity
99.26% (May vary between batches)
Solubility
DMSO:55 mg/mL (126.61 mM)
Smiles
OC=1C (=C (O) C=C2C1C (=O) CC (O2) C3=CC=C (O) C=C3) [C@@H]4O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]4O
Molecular Formula
C21H22O10
Molecular Weight
434.39
Storage Conditions
Keep away from direct sunlight, keep away from moisture, store under nitrogen | Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

Hemiphloin

Hemiphloin is a C-glycosyl compound and a member of flavonoids.

CAS Number71963-94-5
PubChem CID160711
IUPAC Name(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one
Molecular FormulaC21H22O10
Molecular Weight434.4
XLogP-0.1
Topological Polar Surface Area177
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count10
Rotatable Bond Count3
Heavy Atom Count31
Formal Charge0
Complexity638
SMILES
C1[C@H](OC2=C(C1=O)C(=C(C(=C2)O)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)C4=CC=C(C=C4)O
InChI
InChI=1S/C21H22O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-4,6,12,14,17,19-23,25-29H,5,7H2/t12-,14+,17+,19-,20+,21-/m0/s1
InChIKey
QKPKGDDHOGIEOO-JVVVWQBKSA-N
Chemical Structure
2D Structure
2D structure of Hemiphloin
CAS: 71963-94-5
CID: 160711
Formula: C21H22O10
MW: 434.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight434.4
XLogP3-0.1
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count10
Rotatable Bond Count3
Exact Mass434.12129689
Monoisotopic Mass434.12129689
Topological Polar Surface Area177 Ų
Heavy Atom Count31
Formal Charge0
Complexity638
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3614348-01Hemiphloin
HY-N8202(Rac) -Hemiphloin

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