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Home/Compounds/CAS 82-02-0
Formula C14H12O5MW 260.24Research-use catalog entryCOA/SDS by request

Khellin

CAS Number: 82-02-0

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Loading RDKit molecule structure...
InChIKey: HSMPDPBYAYSOBC-UHFFFAOYSA-NC14H12O5 | MW 260.24

Chemical Absolute Identifiers

CAS Number

82-02-0

PubChem CID

3828

Molecular Formula

C14H12O5

Molecular Weight

260.24 g/mol

Exact Mass

260.068473

InChIKey

HSMPDPBYAYSOBC-UHFFFAOYSA-N

IUPAC Name

4,9-dimethoxy-7-methylfuro[3,2-g]chromen-5-one

SMILES String

CC1=CC(=O)C2=C(C3=C(C(=C2O1)OC)OC=C3)OC

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

Khellin (CAS 82-02-0) is listed in the Advanced Chemicals portfolio, with molecular formula C14H12O5 and molecular weight 260. 24 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

Heterocyclic 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 1A2 (Homo sapiens) — 3 assays; Cytochrome P450 1A1 (Homo sapiens) — 3 assays; Cytochrome P450 3A4 (Homo sapiens) — 5 assays; Cytochrome P450 2C19 (Homo sapiens) — 4 assays; Cytochrome P450 2D6 (Homo sapiens) — 4 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Cytochrome P450 1A2

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 2 documents · best pChEMBL 7.7

Experimental evidence source: ChEMBL

Cytochrome P450 1A1

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents · best pChEMBL 5.42

Experimental evidence source: ChEMBL

Cytochrome P450 3A4

Homo sapiens · SINGLE PROTEIN · 5 qualifying assays · 2 documents · best pChEMBL 5.3

Experimental evidence source: ChEMBL

Cytochrome P450 2C19

Homo sapiens · SINGLE PROTEIN · 4 qualifying assays · 2 documents · best pChEMBL 5.3

Experimental evidence source: ChEMBL

Cytochrome P450 2D6

Homo sapiens · SINGLE PROTEIN · 4 qualifying assays · 2 documents · best pChEMBL 5

Experimental evidence source: ChEMBL

Safety & Handling

Handling & Storage

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PPE

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First Aid

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Stability / Reactivity

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  • Carbon monoxide, carbon dioxide.

Disposal

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Fire Fighting

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Accidental Release

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Preliminary Safety Reference

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Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

Khellin

Names & Synonyms

VisamminViscardanKhelloydAmmivinKellina
Show all synonyms
KhellineKhellinumQuelina4,9-Dimethoxy-7-methyl-5H-furo(3,2-g)(1)benzopyran-5-one4,9-Dimethoxy-7-methyl-5H-furo[3,2-g][1]benzopyran-5-one4,9-Dimethoxy-7-methyl-5-oxofuro(3,2-g)-1,2-chromenekelina5H-Furo[3,2-g][1]benzopyran-5-one, 4,9-dimethoxy-7-methyl-5H-Furo(3,2-g)(1)benzopyran-5-one, 4,9-dimethoxy-7-methyl-4,9-dimethoxy-7-methylfuro(3,2-g)chromen-5-oneMethafroneAmicardineAmikellinAmmipuran
External Identifiers
EC NUMBER: 201-392-8DSSTOX SUBSTANCE ID: DTXSID9045267CHEMBL ID: CHEMBL44746CHEBI ID: CHEBI:6133UNII: 5G117T0TJZDRUGBANK ID: DB20030HMDB ID: HMDB0253797KEGG ID: C09010METABOLOMICS WORKBENCH ID: 27986NCI THESAURUS CODE: C75957WIKIDATA ID: Q2079998
Experimental Spectrum References
13C NMR Spectra1D NMR Spectra1H NMR Spectra — Sigma-Aldrich Co. LLC.ATR-IR Spectra — Forensic Spectral ResearchFTIR SpectraVapor Phase IR Spectra
Literature & Patent References
DOI 10.1016/j.isci.2024.108907Identification and evaluation of small-molecule inhibitors against the dNTPase SAMHD1 via a comprehensive screening funnelPMID 38318365Identification and evaluation of small-molecule inhibitors against the dNTPase SAMHD1 via a comprehensive screening funnelDOI 10.1038/s41467-023-40064-9A preclinical secondary pharmacology resource illuminates target-adverse drug reaction associations of marketed drugs.PMID 37468498A preclinical secondary pharmacology resource illuminates target-adverse drug reaction associations of marketed drugs.DOI 10.6019/CHEMBL4651402Screening of ~5500 FDA-approved drugs and clinical candidates for anti-SARS-CoV-2 activityDOI 10.6019/CHEMBL4808148HDAC6 screening dataset using tau-based substrate in an enzymatic assay yields selective inhibitors and activatorsDOI 10.1101/2020.04.03.023846In vitro screening of a FDA approved chemical library reveals potential inhibitors of SARS-CoV-2 replicationDOI 10.21203/rs.3.rs-23951/v1Identification of inhibitors of SARS-CoV-2 in-vitro cellular toxicity in human (Caco-2) cells using a large scale drug repurposing collection

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

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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

3-MethoxyflavoneCAS 7245-02-5
[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetic acidCAS 35679-93-7

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 21829-25-4NifedipineCAS 269055-15-4EtravirineCAS 63612-50-0NilutamideCAS 1617-90-9VincamineCAS 38821-53-3CephradineCAS 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 acidCAS 1018125-49-92-(3-Cyclopropyl-6-ethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acidCAS 1018128-07-8Isopropyl 4-chloro-2-methylquinoline-6-carboxylateCAS 1018142-22-76-cyclopropyl-1-(2,2-difluoroethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

RFQ questions for CAS 82-02-0

What are the key identifiers for Khellin (CAS 82-02-0)?

Khellin is identified by CAS 82-02-0, with molecular formula C14H12O5, molecular weight 260.24, InChIKey HSMPDPBYAYSOBC-UHFFFAOYSA-N.

Does CAS 82-02-0 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Cytochrome P450 1A2, Cytochrome P450 1A1, Cytochrome P450 3A4, Cytochrome P450 2C19, Cytochrome P450 2D6. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 82-02-0?

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

Can I request supplier SDS for Khellin?

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Is CAS 82-02-0 available for quotation?

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