Herbarin B
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Formula: C10H10O5
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Molecular weight: 210.18
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Smiles: CC1=C(OC(=O)C=C1OC)C=CC(=O)O
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Type: Naphthaquinone
Herbarin B
Names
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Mycotoxin name: Herbarin B
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First synonym: None
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Synonyms: Herbarin B,(E)-3-(4-methoxy-3-methyl-6-oxopyran-2-yl)prop-2-enoic acid,CHEBI:206206
Identifiers / External links
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PubChem CID: 11042017
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ChemSpiderID: 9217185
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Chemical Entities of Biological Interest (CHEBI): CHEBI:206206
Structure
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Smiles: CC1=C(OC(=O)C=C1OC)C=CC(=O)O
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Isomeric smiles: CC1=C(OC(=O)C=C1OC)/C=C/C(=O)O
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Inchi: InChI=1S/C10H10O5/c1-6-7(3-4-9(11)12)15-10(13)5-8(6)14-2/h3-5H,1-2H3,(H,11,12)/b4-3+
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Inchikey: RKIATQDHYLUPSL-ONEGZZNKSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C10H10O5
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Molecular weight: 210.18
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Monoisotopic mass: 210.05282342
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Fungi
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Fungi id Species