bacitracin F
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bacitracin F
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CAS No:
22601-63-4
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Formula:
C66H97N16O17S
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Chemical Name:
bacitracin F
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Synonyms:
bacitracin F;Bacitracin H3;N2-[N-[[2-[(S)-2-Methylbutanoyl]thiazol-4-yl]carbonyl]-L-Leu-D-Glu-L-Ile-]cyclo(L-Lys-D-Orn-L-Ile-D-Phe-L-His-D-Asp-L-Asn-);N2-[N-[[2-[(S)-2-Methylbutyryl]thiazole-4-yl]carbonyl]-L-Leu-D-Glu-L-Ile-]cyclo(L-Lys-D-Orn-L-Ile-D-Phe-L-His-D-Asp-L-Asn-);Bacitracin F (>80%);N-[[2-[(2S)-2-Methyl-1-oxobutyl]-4-thiazolyl]carbonyl]-L-leucyl-D-α-glutaMyl-L-isoleucyl-L-lysyl-D-ornithyl-L-isoleucyl-D-phenylalanyl-L-histidyl-D-α-aspartyl-L-asparagine(10→4)-LactaM;Bacitracin F (~75%)
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CAS No:
bacitracin F Use and Manufacturing
Bacitracin F is a major Bacitracin (B106500) analog, a peptide antibiotic used as an inhibitor of protein disulfide isomerase (PDI).
Computed Properties
Molecular Weight:1419.6
XLogP3:-0.5
Hydrogen Bond Donor Count:16
Hydrogen Bond Acceptor Count:21
Rotatable Bond Count:31
Exact Mass:1418.70165689
Monoisotopic Mass:1418.70165689
Topological Polar Surface Area:551
Heavy Atom Count:100
Complexity:2830
Undefined Atom Stereocenter Count:13
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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