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Home/Compounds/CAS 487-49-0
Formula C15H14O4MW 258.27Research-use catalog entryCOA/SDS by request

Ononetin

CAS Number: 487-49-0

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Loading RDKit molecule structure...
InChIKey: XHBZOAYMBBUURD-UHFFFAOYSA-NC15H14O4 | MW 258.27

Chemical Absolute Identifiers

CAS Number

487-49-0

PubChem CID

259632

Molecular Formula

C15H14O4

Molecular Weight

258.27 g/mol

Exact Mass

258.089209

InChIKey

XHBZOAYMBBUURD-UHFFFAOYSA-N

IUPAC Name

1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenyl)ethanone

SMILES String

COC1=CC=C(C=C1)CC(=O)C2=C(C=C(C=C2)O)O

Physical Properties

No physical property values available.

Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.

Catalog Facts

Structural features

Ononetin (CAS 487-49-0) is listed in the Advanced Chemicals portfolio, with molecular formula C15H14O4 and molecular weight 258. 27 g/mol.

Sourcing context

Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.

Research use context

Intended for research building-block and synthetic chemistry workflows.

Documentation needs

COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.

Applications & Classification

Organic Building BlocksSynthetic ChemistryResearch intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: Cytochrome P450 3A4 (Homo sapiens) — 2 assays; Nuclear receptor ROR-gamma (Mus musculus) — 2 assays; Tyrosinase (Agaricus bisporus) — 2 assays; ATPase family AAA domain-containing protein 5 (Homo sapiens) — 2 assays; Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Cytochrome P450 3A4

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 4.9

Experimental evidence source: ChEMBL

Nuclear receptor ROR-gamma

Mus musculus · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 4.45

Experimental evidence source: ChEMBL

Tyrosinase

Agaricus bisporus · SINGLE PROTEIN · 2 qualifying assays · 2 documents · best pChEMBL 4.1

Experimental evidence source: ChEMBL

ATPase family AAA domain-containing protein 5

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

Tyrosyl-DNA phosphodiesterase 1

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

Safety & Handling

Handling & Storage

  • Including any incompatibility.
  • Close tightly.
  • Store in a well-ventilated area.

PPE

Respiratory protection if needed

First Aid

  • Do not give anything to an unconscious person.
  • Rinse mouth with water.

Stability / Reactivity

  • Reactivity and reaction.
  • Carbon monoxide, carbon dioxide.

Disposal

  • The product, remaining and non-recyclable solutions should be handed over to a licensed company for disposal.
  • Contact a professional institution with a waste disposal license to handle this substance.
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Fire Fighting

  • If necessary, wear a self-contained breathing apparatus for firefighting.

Accidental Release

  • Do not generate dust when collecting and disposing.
  • Sweep and shovel up.

For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.

Preliminary Safety Reference

For supplier-issued SDS or COA, submit a documentation request.

Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

Ononetin

Names & Synonyms

Acetophenone, 2',4'-dihydroxy-2-(p-methoxyphenyl)-Ethanone, 1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenyl)-2,4-DIHYDROXYPHENYL 4'-METHOXYBENZYL KETONE.ALPHA.-(4-METHOXYPHENYL)-2,4-DIHYDROXYACETOPHENONEALPHA-(4-METHOXYPHENYL)-2,4-DIHYDROXYACETOPHENONE
Show all synonyms
2',4'-dihydroxy-2-(4-methoxyphenyl)acetophenone1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenyl)ethan-1-oneA1D6M1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenyl)-ethanoneSpectrum_000796Spectrum2_000808Spectrum3_001777Spectrum4_001479Spectrum5_000157Oprea1_716474BSPBio_001797BSPBio_003273KBioGR_002057KBioSS_001276
External Identifiers
EC NUMBER: 650-984-6DSSTOX SUBSTANCE ID: DTXSID50197590CHEMBL ID: CHEMBL241858CHEBI ID: CHEBI:182312UNII: 4S084Z7YS4WIKIDATA ID: Q83070416
Experimental Spectrum References
13C NMR Spectra1H NMR SpectraATR-IR Spectra — Forensic Spectral ResearchFTIR SpectraRaman Spectra — Forensic Spectral ResearchUV-VIS Spectra
Literature & Patent References
DOI 10.1124/mol.112.084152Structure-based identification of OATP1B1/3 inhibitors.PMID 23571415Structure-based identification of OATP1B1/3 inhibitors.DOI 10.1016/j.bmcl.2012.07.029Design, synthesis and molecular simulation studies of dihydrostilbene derivatives as potent tyrosinase inhibitors.PMID 22835872Design, synthesis and molecular simulation studies of dihydrostilbene derivatives as potent tyrosinase inhibitors.DOI 10.1016/j.bmc.2009.05.019Potential antioxidants and tyrosinase inhibitors from synthetic polyphenolic deoxybenzoins.DOI 10.1016/j.ejmech.2008.06.001Amines and oximes derived from deoxybenzoins as Helicobacter pylori urease inhibitors.PMID 18625539Amines and oximes derived from deoxybenzoins as Helicobacter pylori urease inhibitors.PMID 19481947Potential antioxidants and tyrosinase inhibitors from synthetic polyphenolic deoxybenzoins.

Documentation & Compliance Facts

Compliance Facts

Shipment review: Required

Documentation available by request

Certificate of Analysis (COA): By request

Supplier Safety Data Sheet (SDS): By request

Purity and pack size confirmation: By request

Availability and lead time review: Confirmed by RFQ

Shipment documentation review: By request

For supplier-issued documentation by request, use the RFQ actions on this page.Review preliminary safety reference

What happens after RFQ

  1. 1We review the CAS identity, quantity, and documentation request.
  2. 2We check sourcing options, supplier availability, COA/SDS, purity, pack size, and lead time.
  3. 3We review destination and shipment documentation needs when applicable.
  4. 4We follow up with a quotation or clarification request.

Text Reference Cues

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Non-public related references

2,4,4'-TrihydroxydeoxybenzoinCAS 17720-60-4
Benzyl 2,4-Dihydroxyphenyl KetoneCAS 3669-41-8
2-Phenyl-1-(2,4,6-trihydroxyphenyl)ethanoneCAS 727-71-9
1-(4-Bromo-2-hydroxyphenyl)-2-(2,5-dibromophenyl)ethanoneCAS 1403991-85-4
IsoliquiritigeninCAS 961-29-5

Non-public references are shown as text only and do not imply equivalence, availability, or shared use.

Catalog navigation

Related Catalog Entries

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.

CAS 17720-60-42,4,4'-TrihydroxydeoxybenzoinCAS 3669-41-8Benzyl 2,4-Dihydroxyphenyl KetoneCAS 727-71-92-Phenyl-1-(2,4,6-trihydroxyphenyl)ethanoneCAS 65646-68-6FenretinideCAS 21829-25-4NifedipineCAS 50-65-7NiclosamideCAS 102146-07-6DpcpxCAS 104227-87-4FamciclovirCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamateCAS 1005174-17-3(E)-3-(2-Propyl-6-(trifluoromethyl)pyridin-3-yl)acrylic acid

RFQ questions for CAS 487-49-0

What are the key identifiers for Ononetin (CAS 487-49-0)?

Ononetin is identified by CAS 487-49-0, with molecular formula C15H14O4, molecular weight 258.27, InChIKey XHBZOAYMBBUURD-UHFFFAOYSA-N.

Does CAS 487-49-0 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Cytochrome P450 3A4, Nuclear receptor ROR-gamma, Tyrosinase, ATPase family AAA domain-containing protein 5, Tyrosyl-DNA phosphodiesterase 1. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 487-49-0?

Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.

Can I request supplier SDS for Ononetin?

Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.

Is CAS 487-49-0 available for quotation?

Availability, pack size, lead time, and pricing are confirmed through RFQ.

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