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Ononin

CAT: 0931-T6S0270-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T6S0270-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
486-62-4
Target
P38 MAPK, Akt, Apoptosis, mTOR, ERK, PI3K, JNK, Antibacterial
Related Pathways
PI3K/Akt/mTOR signaling, Microbiology/Virology, MAPK, Cytoskeletal Signaling, Apoptosis
Purity
0.9992
Bioactivity
1. Ononin (Formononetin 7-O-glucoside) can inhibit the growth of pathogen. 2. Ononin plays an important role in human nutrition as health promoting natural chemicals and are established to be the beneficial components.
Smiles
COc1ccc(cc1)-c1coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2c1=O
Molecular Formula
C22H22O9
Molecular Weight
430.4
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ononin

Ononin is a 4'-methoxyisoflavone that is formononetin attached to a beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage. It has a role as a plant metabolite. It is a member of 4'-methoxyisoflavones, a 7-hydroxyisoflavones 7-O-beta-D-glucoside and a monosaccharide derivative. It is functionally related to a formononetin.

CAS Number486-62-4
PubChem CID442813
IUPAC Name3-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular FormulaC22H22O9
Molecular Weight430.4
XLogP1
Topological Polar Surface Area135
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity659
SMILES
COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
InChI
InChI=1S/C22H22O9/c1-28-12-4-2-11(3-5-12)15-10-29-16-8-13(6-7-14(16)18(15)24)30-22-21(27)20(26)19(25)17(9-23)31-22/h2-8,10,17,19-23,25-27H,9H2,1H3/t17-,19-,20+,21-,22-/m1/s1
InChIKey
MGJLSBDCWOSMHL-MIUGBVLSSA-N
Chemical Structure
2D Structure
2D structure of Ononin
CAS: 486-62-4
CID: 442813
Formula: C22H22O9
MW: 430.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight430.4
XLogP31
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass430.12638228
Monoisotopic Mass430.12638228
Topological Polar Surface Area135 Ų
Heavy Atom Count31
Formal Charge0
Complexity659
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

Related Products

CatalogName
T23107-01Ononetin

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CatalogName
HY-N0270-01Ononin
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A14578-100Ononin 100mg
A14578-20Ononin 20mg
A14578-10Ononin 10mg

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