2-tolylacetyl-coenzyme A
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2-tolylacetyl-coenzyme A
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CAS No:
124924-91-0
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Formula:
C30H44N7O17P3S
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Chemical Name:
2-tolylacetyl-coenzyme A
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Synonyms:
2-tolylacetyl-CoA;2-tolylacetyl-coenzyme A;coenzyme A, 2-tolylacetyl-;o-tolylacetyl-coenzyme A;124924-91-0;2-Tolylacetyl-coa;o-Tolylacetyl-coenzyme A;2-Tolylacetyl-coenzyme A;Coenzyme A, 2-tolylacetyl-;DTXSID70924966;2-Tolylacetyl-CoA; (Acyl-CoA); [M+H]+;;9-{5-O-[({[3,4-Dihydroxy-4-({3-hydroxy-3-[(2-{[(2-methylphenyl)acetyl]sulfanyl}ethyl)imino]propyl}imino)-2,2-dimethylbutoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H
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CAS No:
Computed Properties
Molecular Weight:899.7
XLogP3:-3.7
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:22
Rotatable Bond Count:22
Exact Mass:899.17272513
Monoisotopic Mass:899.17272513
Topological Polar Surface Area:389
Heavy Atom Count:58
Complexity:1570
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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