6-hydroxymethyleugenin
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Formula: C12H12O5
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Molecular weight: 236.22
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Smiles: CC1=CC(=O)C2=C(C(=C(C=C2O1)OC)CO)O
6-hydroxymethyleugenin
Names
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Mycotoxin name: 6-hydroxymethyleugenin
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First synonym: 6-hydroxymethyleugenin
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Synonyms: 6-hydroxymethyleugenin,6-Hydroxymethyleugenetin,MLS004257386,CHEMBL464246,SMR003082517,2-Methyl-5-hydroxy-6-(hydroxymethyl)-7-methoxychromone
Identifiers / External links
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CAS: 37042-21-0
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PubChem CID: 12084957
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ChemSpiderID: 10232956
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ChEMBL: CHEMBL464246
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Chemical Entities of Biological Interest (CHEBI): CHEBI:211179
Structure
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Smiles: CC1=CC(=O)C2=C(C(=C(C=C2O1)OC)CO)O
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Isomeric smiles: CC1=CC(=O)C2=C(C(=C(C=C2O1)OC)CO)O
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Inchi: InChI=1S/C12H12O5/c1-6-3-8(14)11-10(17-6)4-9(16-2)7(5-13)12(11)15/h3-4,13,15H,5H2,1-2H3
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Inchikey: NDYIQSCPWYVZEJ-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C12H12O5
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Molecular weight: 236.22
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Monoisotopic mass: 236.06847348
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Fungi
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Fungi id Species 1139 Tolypocladium extinguens