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2′-Hydroxyformononetin

CAT: 0931-T204524-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T204524-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1890-99-9
Target
Others
Related Pathways
Others
Bioactivity
2’-Hydroxyformononetin is an isoflavone compound that may exhibit anti-inflammatory and antioxidant properties.
Smiles
O=C1C(=COC2=CC(O)=CC=C12)C=3C=CC(OC)=CC3O
Molecular Formula
C16H12O5
Molecular Weight
284.263
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2'-Hydroxyformononetin

2'-hydroxyformononetin is a member of the class of 4'-methoxyisoflavones that is formononetin with a hydroxy group at the 2'position. It has a role as an anti-inflammatory agent. It is a member of 4'-methoxyisoflavones and a member of 7-hydroxyisoflavones. It is functionally related to a formononetin. It is a conjugate acid of a 2'-hydroxyformononetin(1-).

CAS Number1890-99-9
PubChem CID5280551
IUPAC Name7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)chromen-4-one
Molecular FormulaC16H12O5
Molecular Weight284.26
XLogP2.4
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity432
SMILES
COC1=CC(=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O
InChI
InChI=1S/C16H12O5/c1-20-10-3-5-11(14(18)7-10)13-8-21-15-6-9(17)2-4-12(15)16(13)19/h2-8,17-18H,1H3
InChIKey
XKHHKXCBFHUOHM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2'-Hydroxyformononetin
CAS: 1890-99-9
CID: 5280551
Formula: C16H12O5
MW: 284.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight284.26
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass284.06847348
Monoisotopic Mass284.06847348
Topological Polar Surface Area76 Ų
Heavy Atom Count21
Formal Charge0
Complexity432
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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