Asperentin-8-methyl ether
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Formula: C17H22O5
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Molecular weight: 306.40
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Smiles: CC1CCCC(O1)CC2CC3=C(C(=CC(=C3)O)OC)C(=O)O2
Asperentin-8-methyl ether
Names
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Mycotoxin name: Asperentin-8-methyl ether
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First synonym: Asperentin-8-methyl ether
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Synonyms: asperentin-8-methyl ether,asperentin 8-O-methylether,cladosporin 8-O-methylether,CHEBI:68703,Q27137123,6-hydroxy-8-methoxy-3-{[(2R,6S)-6-methyltetrahydro-2H-pyran-2-yl]methyl}-3,4-dihydro-1H-isochromen-1-one
Identifiers / External links
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CAS: 38747-37-4
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PubChem CID: 71728345
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ChemSpiderID: 29368025
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Wikidata (wiki): Q27137123
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Chemical Entities of Biological Interest (CHEBI): CHEBI:68703
Structure
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Smiles: CC1CCCC(O1)CC2CC3=C(C(=CC(=C3)O)OC)C(=O)O2
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Isomeric smiles: C[C@H]1CCC[C@@H](O1)CC2CC3=C(C(=CC(=C3)O)OC)C(=O)O2
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Inchi: InChI=1S/C17H22O5/c1-10-4-3-5-13(21-10)9-14-7-11-6-12(18)8-15(20-2)16(11)17(19)22-14/h6,8,10,13-14,18H,3-5,7,9H2,1-2H3/t10-,13+,14?/m0/s1
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Inchikey: COFDRZBGPVKKJQ-CMVMAMJTSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C17H22O5
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Molecular weight: 306.40
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Monoisotopic mass: 306.1467238
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Fungi
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Fungi id Species 334 Chaetomium globosum