5-Hydroxymethylfurfural
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Formula: C6H6O3
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Molecular weight: 126.11
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Smiles: C1=C(OC(=C1)C=O)CO
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Type: Furan
5-Hydroxymethylfurfural
Names
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Mycotoxin name: 5-Hydroxymethylfurfural
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First synonym: None
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Synonyms: 5-HYDROXYMETHYLFURFURAL,67-47-0,5-Hydroxymethyl-2-furaldehyde,5-(hydroxymethyl)furan-2-carbaldehyde,5-(Hydroxymethyl)furfural,5-(Hydroxymethyl)-2-furaldehyde,Hydroxymethylfurfural,5-(Hydroxymethyl)-2-furfural,5-Oxymethylfurfurole,5-Hydroxymethylfuraldehyde,Hydroxymethylfurfurole,5-(Hydroxymethyl)-2-furancarbonal,5-Hydroxymethylfuran-2-aldehyde,Hydroxymethylfurfuraldehyde,5-Hydroxymethyl-2-formylfuran,Hydroxymethylfurfuralaldehyde,2-Hydroxymethyl-5-furfural,5-Hydroxymethyl-2-furfural,2-Furancarboxaldehyde, 5-(hydroxymethyl)-,5-(Hydroxymethyl)-2-furfuraldehyde,5-Hydroxymethylfurfuraldehyde,5-(Hydroxymethyl)-2-furancarboxaldehyde,5-(Hyddroxymethyl)furfurole,Aes-103,HMF,NSC-40738,5-Hydroxymethyl-2-furancarboxaldehyde,5-HYDROXYMETHYL-FURFURAL,5-HMF,2-Furaldehyde, 5-(hydroxymethyl)-,MFCD00003234,5-Hydroxymethyl-2-furfuraldehyde,CHEBI:412516,5-(Hydroxymethyl)furan-2-aldehyde,5-Hydroxymethyl-2-furancarbaldehyde,NSC 40738,5-(Hydroxymethyl)furfurole,70ETD81LF0,DTXSID3030428,5-(Hydroxymethyl)-2-formylfuran,5-Hydroxymethyl-furan-2-carbaldehyde,5-hydroxymethyl furfural,DTXCID1010428,CAS-67-47-0,CCRIS 3160,EINECS 200-654-9,Aes 103,BRN 0110889,UNII-70ETD81LF0,HSDB 7982,5-methylolfurfural,5-(Hydroxymethyl)furan-2-carboxaldehyde,5hydroxymethyl_furfural,5-Hydrxoymethylfurfural,5-formylfurfuryl alcohol,5HMF,5-hydroxy methyl furfural,Epitope ID:136033,5-Hydroxymethyl furaldehyde,CBiol_000485,SCHEMBL19176,5-18-01-00130 (Beilstein Handbook Reference),MLS002454379,2-formyl-5-hydroxymethylfuran,CHEMBL185885,QSPL 022,GTPL10939,HYDROXYMETHYLFURFURAL, 5-,5-hydroxymethylfuran-2-carbaldehyde,BCP31207,CS-D1116,HY-Y0051,NSC40738,Tox21_201892,Tox21_303551,BBL100102,BDBM50487911,GEO-01528,ICCB3_000133,s3772,STL451297,5-Hydroxymethyl-2-furaldehyde, 99%,5-(hydroxymethyl)-2-furfural (HMF),AKOS005166879,AC-1262,CCG-266098,DB12298,GS-3074,5-(hydroxymethyl)-furan-2-carbaldehyde,NCGC00091513-01,NCGC00091513-02,NCGC00257266-01,NCGC00259441-01,5-(hydroxymethyl)-2-furan-carboxaldehyde,5-(Hydroxymethyl)furfural, >=99%, FG,SMR000393981,SY010869,5-(hydroxy methyl) 2-furan-carboxaldehyde,DB-007058,H0269,NS00014938,5-(HYDROXYMETHYL)-2-FURALDEHYDE [MI],EN300-82764,5-(Hydroxymethyl)furfural, analytical standard,Q414606,Q-200545,5-Hydroxymethylfurfural 5-Hydroxymethyl-2-furaldehyde,801 - Honey essential composition and quality factors,BRD-K86799112-001-02-0,BRD-K86799112-001-03-8,5-hydroxymethylfurfural 5-(hydroxymethyl)-2-furaldehyde,F2191-0155,Z1238542812,InChI=1/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H,FC-801-QC sample 801 - Essential composition and quality factors - Honey,GLUCOSAMINE SULFATE POTASSIUM CHLORIDE IMPURITY E [ EP IMPURITY]
Identifiers / External links
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CAS: 18-01-0,67-47-0,001-02-0,001-03-8
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PubChem CID: 237332
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DSS TOX CID: DTXCID1010428
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ChemSpiderID: 2028720
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ChEMBL: CHEMBL185885,CHEMBL19176
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US FDA (UNII): UNII-70ETD81LF0
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Wikidata (wiki): Q414606
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Chemical Entities of Biological Interest (CHEBI): CHEBI:412516
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CompTox Chemicals Dashboard (DTXSID): DTXSID3030428
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SCHEMBL: SCHEMBL19176
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TOX21 samples 2:Tox21_201892,Tox21_303551
Structure
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Smiles: C1=C(OC(=C1)C=O)CO
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Isomeric smiles: C1=C(OC(=C1)C=O)CO
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Inchi: InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
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Inchikey: NOEGNKMFWQHSLB-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C6H6O3
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Molecular weight: 126.11
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Monoisotopic mass: 126.031694049
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Fungi
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Fungi id Species