F 13459

Formula: C27H28O11
Molecular weight: 528.50
Smiles: CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)OC3C4=C(C(=CC(=C4)O)O)C(=O)OC3(C)O)O

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F 13459

Names

Structural Information

Physico-chemical Properties

ADME

Toxicity

Medical Chemistry

Fungi

Mycotoxin name: F 13459
First synonym: None
Synonyms: DN6NGB2QQ2,F-13459,F13459,4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (2R,3R)-3,4-dihydro-3,6,8-trihydroxy-3-methyl-1-oxo-1H-2-benzopyran-4-yl ester, (4E)-rel-,4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (3R,4R)-3,4-dihydro-3,6,8-trihydroxy-3-methyl-1-oxo-1H-2-benzopyran-4-yl ester, (4E)-rel-,357608-27-6,UNII-DN6NGB2QQ2,(3,6,8-Trihydroxy-3-methyl-1-oxo-4H-isochromen-4-yl) (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate,F 13459,3,6,8-Trihydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-4-yl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid

Smiles: CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)OC3C4=C(C(=CC(=C4)O)O)C(=O)OC3(C)O)O
Isomeric smiles: CC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\C)/CCC(=O)O[C@@H]3C4=C(C(=CC(=C4)O)O)C(=O)O[C@@]3(C)O)O
Inchi: InChI=1S/C27H28O11/c1-12(5-7-15-22(31)21-17(11-36-25(21)32)13(2)23(15)35-4)6-8-19(30)37-24-16-9-14(28)10-18(29)20(16)26(33)38-27(24,3)34/h5,9-10,24,28-29,31,34H,6-8,11H2,1-4H3/b12-5+/t24-,27-/m1/s1
Inchikey: HFLIGULWCMOSDN-YWGGKZFVSA-N

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Fungi id	Species
939	Penicillium sp. F13459