Pochonin D
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Formula: C18H19ClO5
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Molecular weight: 350.80
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Smiles: CC1CC=CCCC=CC(=O)CC2=C(C(=CC(=C2Cl)O)O)C(=O)O1
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Type: Resorcyl lactone
Pochonin D
Names
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Mycotoxin name: Pochonin D
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First synonym: None
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Synonyms: Pochonin D,CHEMBL526127,544712-82-5,(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaene-2,12-dione,(4E,8E,11R)-18-chloro-15,17-dihydroxy-11-methyl-12-oxabicyclo(12.4.0)octadeca-1(14),4,8,15,17-pentaene-3,13-dione,(4E,8E,11R)-18-chloro-15,17-dihydroxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),4,8,15,17-pentaene-3,13-dione,(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-3-oxabicyclo(12.4.0)octadeca-1(14),6,10,15,17-pentaene-2,12-dione,SCHEMBL4513578,BDBM50265817
Identifiers / External links
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CAS: 544712-82-5
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PubChem CID: 11405422
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ChEMBL: CHEMBL526127,CHEMBL4513578
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SCHEMBL: SCHEMBL4513578
Structure
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Smiles: CC1CC=CCCC=CC(=O)CC2=C(C(=CC(=C2Cl)O)O)C(=O)O1
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Isomeric smiles: C[C@@H]1C/C=C/CC/C=C/C(=O)CC2=C(C(=CC(=C2Cl)O)O)C(=O)O1
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Inchi: InChI=1S/C18H19ClO5/c1-11-7-5-3-2-4-6-8-12(20)9-13-16(18(23)24-11)14(21)10-15(22)17(13)19/h3,5-6,8,10-11,21-22H,2,4,7,9H2,1H3/b5-3+,8-6+/t11-/m1/s1
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Inchikey: FJVQHTGEXYKKBS-CJRGTMQESA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C18H19ClO5
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Molecular weight: 350.80
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Monoisotopic mass: 350.0921014
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Fungi
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Fungi id Species