Dehydrocyclopeptine
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Dehydrocyclopeptine
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CAS No:
31965-37-4
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Formula:
C17H14N2O2
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Chemical Name:
Dehydrocyclopeptine
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Synonyms:
1H-1,4-Benzodiazepine-2,5-dione,3,4-dihydro-4-methyl-3-(phenylmethylene)-;1H-1,4-Benzodiazepine-2,5-dione,3-benzylidene-3,4-dihydro-4-methyl-;3,4-Dihydro-4-methyl-3-(phenylmethylene)-1H-1,4-benzodiazepine-2,5-dione;Dehydrocyclopeptine;Cyclopeptine,dehydro-;3,10-Dehydrocyclopeptine
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CAS No:
Description
ChEBI: A 1,4-benzodiazepinone that is 3,4-dihydro-1,4-benzodiazepine-2,5-dione substituted at position 4 by a methyl group and at position 3 by a benzylidene group.
Dehydrocyclopeptine Use and Manufacturing
Dehydrocyclopeptine is a benzodiazepine metabolite produced by a number of species of Penicillium. While there is little literature about the metabolite, there is considerable interest in the enzymes responsible for the biosynthesis of the benzodiazepine nucleus, cyclopeptine synthetase.
Computed Properties
Molecular Weight:278.30
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:278.105527694
Monoisotopic Mass:278.105527694
Topological Polar Surface Area:49.4
Heavy Atom Count:21
Complexity:452
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes