FUMIGATIN
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FUMIGATIN
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CAS No:
484-89-9
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Formula:
C8H8O4
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Chemical Name:
FUMIGATIN
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Synonyms:
fumigatin;UNII-D4Y1CD8EH8;D4Y1CD8EH8;3-Hydroxy-2-methoxy-5-methyl-2,5-cyclohexadiene-1,4-dione;2-hydroxy-3-methoxy-6-methyl-1,4-benzoquinone;3-demethylubiquinone 0;3-hydroxy-2-methoxy-5-methylcyclohexa-2,5-diene-1,4-dione;SCHEMBL1915628;DTXSID10197516
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CAS No:
Description
Fumigatin is a member of the class of monohydroxy-1,4-benzoquinones that is 1,4-benzoquinone which is substituted by a methoxy, hydroxy and methyl group at positions 2,3 and 5, respectively. It is a mycotoxin isolated from Aspergillus fumigatus. It has a role as an Aspergillus metabolite and a mycotoxin. It derives from a 2,3-dihydroxy-5-methyl-1,4-benzoquinone.
Computed Properties
Molecular Weight:168.15
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:168.04225873
Monoisotopic Mass:168.04225873
Topological Polar Surface Area:63.6
Heavy Atom Count:12
Complexity:309
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes