9,22-Dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo[12.12.3]nonacosane,cyclic peptide deriv.
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![9,22-Dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo[12.12.3]nonacosane,cyclic peptide deriv. structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/aa206f947562458596c7c4a28d9088dc.png "9,22-Dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo[12.12.3]nonacosane,cyclic peptide deriv.")
9,22-Dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo[12.12.3]nonacosane,cyclic peptide deriv.
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CAS No:
11001-74-4
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Formula:
C55H72N12O12S2
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Chemical Name:
9,22-Dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo[12.12.3]nonacosane,cyclic peptide deriv.
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Synonyms:
L-Alloisoleucine,N-(2-quinoxalinylcarbonyl)-O-[N-(2-quinoxalinylcarbonyl)-D-seryl-L-alanyl-3-mercapto-N,S-dimethylcysteinyl-N,4-dimethyl-L-alloisoleucyl]-D-seryl-L-alanyl-N-methylcysteinyl-N,4-dimethyl-,(8→1)-lactone,cyclic (3→7)-thioether;Quinomycin C;Quinomycin A,4-(N,4-dimethyl-L-alloisoleucine)-8-(N,4-dimethyl-L-alloisoleucine)-;9,22-Dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo[12.12.3]nonacosane,cyclic peptide deriv.;Antibiotic U 48160;13602-51-2
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CAS No:
9,22-Dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo[12.12.3]nonacosane,cyclic peptide deriv. Basic Attributes
1157.4 g/mol
1157.36
Computed Properties
Molecular Weight:1157.4
XLogP3:4.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:9
Exact Mass:1156.48340813
Monoisotopic Mass:1156.48340813
Topological Polar Surface Area:352
Heavy Atom Count:81
Complexity:2300
Undefined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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