Chaetoxanthone c
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Formula: C20H19ClO6
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Molecular weight: 390.80
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Smiles: CC1CCCC(O1)C2=C(C(=C3C(=C2O)C(=O)C4=C(O3)C=CC=C4OC)Cl)O
Chaetoxanthone c
Names
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Mycotoxin name: Chaetoxanthone c
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First synonym: Chaetoxanthone c
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Synonyms: Chaetoxanthone C,CHEBI:65613,4-chloro-1,3-dihydroxy-8-methoxy-2-[(2R,6R)-6-methyltetrahydro-2H-pyran-2-yl]-9H-xanthen-9-one,CHEMBL499872,Q27134079
Identifiers / External links
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CAS: 1052639-26-5
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PubChem CID: 25058081
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ChemSpiderID: 24707899
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ChEMBL: CHEMBL499872
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Wikidata (wiki): Q27134079
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Chemical Entities of Biological Interest (CHEBI): CHEBI:65613
Structure
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Smiles: CC1CCCC(O1)C2=C(C(=C3C(=C2O)C(=O)C4=C(O3)C=CC=C4OC)Cl)O
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Isomeric smiles: C[C@@H]1CCC[C@@H](O1)C2=C(C(=C3C(=C2O)C(=O)C4=C(O3)C=CC=C4OC)Cl)O
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Inchi: InChI=1S/C20H19ClO6/c1-9-5-3-7-12(26-9)14-18(23)15-17(22)13-10(25-2)6-4-8-11(13)27-20(15)16(21)19(14)24/h4,6,8-9,12,23-24H,3,5,7H2,1-2H3/t9-,12-/m1/s1
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Inchikey: MWYMVCYBLZZWPG-BXKDBHETSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C20H19ClO6
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Molecular weight: 390.80
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Monoisotopic mass: 390.087016
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Fungi
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Fungi id Species 347 Chaetomium sp.