Epicocconone

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Epicocconone

Names

Structural Information

Physico-chemical Properties

ADME

Toxicity

Medical Chemistry

Fungi

Mycotoxin name: Epicocconone
First synonym: Epicocconone
Synonyms: epicocconone,Lightning Fast,Deep Purple,Lava Purple,UNII-6QLH9631R8,371163-96-1,6QLH9631R8,(6S,9aS)-3-((1Z,4E,6E,8E)-1-hydroxy-3-oxodeca-1,4,6,8-tetraen-1-yl)-6-(hydroxymethyl)-9a-methyl-5,6-dihydro-2H-furo[3,2-g]isochromene-2,9(9aH)-dione,(6S,9aS)-6-(hydroxymethyl)-3-[(1Z,4E,6E,8E)-1-hydroxy-3-oxodeca-1,4,6,8-tetraen-1-yl]-9a-methyl-5,6-dihydro-2H-furo[3,2-g]isochromene-2,9(9aH)-dione,Epicocconone [MI],SCHEMBL9999829,CHEBI:51226,(6S,9aS)-5,6-Dihydro-6-(hydroxymethyl)-3-((1Z,4E,6E,8E)-1-hydroxy-3-oxo-1,4,6,8-decatetraen-1-yl)-9a-methyl-2H-furo(3,2-g)(2)benzopyran-2,9(9ah)-dione,2H-Furo(3,2-g)(2)benzopyran-2,9(9ah)-dione, 5,6-dihydro-6-(hydroxymethyl)-3-((1Z,4E,6E,8E)-1-hydroxy-3-oxo-1,4,6,8-decatetraen-1-yl)-9a-methyl-, (6S,9aS)-,Q1346935,(6S,9aS)-6-(hydroxymethyl)-3-[(1Z,4E,6E,8E)-1-hydroxy-3-oxodeca-1,4,6,8-tetraenyl]-9a-methyl-5,6-dihydrofuro[3,2-g]isochromene-2,9-dione

Smiles: CC=CC=CC=CC(=O)C=C(C1=C2C=C3CC(OC=C3C(=O)C2(OC1=O)C)CO)O
Isomeric smiles: C/C=C/C=C/C=C/C(=O)/C=C(/C1=C2C=C3C[C@H](OC=C3C(=O)[C@]2(OC1=O)C)CO)\O
Inchi: InChI=1S/C23H22O7/c1-3-4-5-6-7-8-15(25)11-19(26)20-18-10-14-9-16(12-24)29-13-17(14)21(27)23(18,2)30-22(20)28/h3-8,10-11,13,16,24,26H,9,12H2,1-2H3/b4-3+,6-5+,8-7+,19-11-/t16-,23-/m0/s1
Inchikey: JKMBMIMLVFMXRW-LYYFRFARSA-N

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Category	Sub category	Endpoint	Tool	QSAR ID	Value	Unit	Comments	Reference

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Endpoint	Tool	Value	Unit	Comments	Reference

Fungi id	Species
500	Epicoccum nigrum