3-chloropropionyl-coenzyme A, 3'-(32)P-labeled
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3-chloropropionyl-coenzyme A, 3'-(32)P-labeled
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CAS No:
96212-36-1
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Formula:
C24H39ClN7O17P3S
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Chemical Name:
3-chloropropionyl-coenzyme A, 3'-(32)P-labeled
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Synonyms:
3-chloropropionyl-CoA;3-chloropropionyl-coenzyme A;3-chloropropionyl-coenzyme A, 14C-labeled;3-chloropropionyl-coenzyme A, 3'-(32)P-labeled;coenzyme A, 3-chloropropionyl-;3-Chloropropionyl-coenzyme A;96212-36-1;3-Chloropropionyl-coa;Coenzyme A, 3-chloropropionyl-;DTXSID10914609;S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-chloropropanethioate;3-Chloropropionyl-CoA; (Acyl-CoA); [M+H]+;;9-{5-O-[{[(4-{[3-({2-[(3-Chloropropanoyl)sulfanyl]ethyl}imino)-3-hydroxypropyl]imino}-3,4-dihydroxy-2,2-dimethylbutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-puri
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CAS No:
Computed Properties
Molecular Weight:858.0
XLogP3:-5.1
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:22
Rotatable Bond Count:22
Exact Mass:857.1024527
Monoisotopic Mass:857.1024527
Topological Polar Surface Area:389
Heavy Atom Count:53
Complexity:1420
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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