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Identification
CAS Number
1926-57-4
Name
Coenzyme A, s-(2-hydroxypropanoate)
Synonyms
1926-57-42-Hydroxypropanethioate de S-{(9R)-1--3,5,9-trihydroxy-8,8-diméthyl-10,14-dioxo-3,5-dioxydo-2,4,6-trioxa-11,15-d iaza-3λ~5~,5λ~5~-diphosphaheptadécan-17-yle}2-hydroxypropanoyl CoA2-hydroxypropanoyl coenzyme AAdenosine, 5′-O-ethyl]amino]-3-oxopropyl]amino]-2,2-dimethyl-4-oxobutoxy]phosphinyl]oxy]phosphinyl]-, 3′-(dihydrogen phosphate)Coenzyme A, S-(2-hydroxypropanoate)S-{(9R)-1--3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3λ~5~,5λ~5~- diphosphaheptadecan-17-yl} 2-hydroxypropanethioateS-{(9R)-1--3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3λ~5~,5λ~5~- diphosphaheptadecan-17-yl}-2-hydroxypropanthioatUnverified2-hydroxypropionyl CoA3′-phosphoadenosine 5′-{3-ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}ethyl}carbamoyl)ethyl]carbamoyl}-2,2-dimethylpropoxyphosphoryl]oxyphosphoryl}oxy)methyl]oxolan-3-yl]oxyphosphonic acidCoenzyme A, lactoyl-lactoyl-CoALactoyl-coenzyme ALactyl-coaS-(2-hydroxypropanoate)coenzyme AS-(2-hydroxypropanoyl)coenzyme A{ethyl}carbamoyl)ethyl]carbamoyl}-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acidα-hydroxypropanoyl CoAα-hydroxypropanoyl coenzyme Aα-hydroxypropionyl CoAα-hydroxypropionyl coenzyme A
SMILES
CC(O)C(=O)SCCNC(=O)CCNC(=O)C@HC(C)(C)COP(=O)(O)OP(=O)(O)OC1OC@@HC@H1OP(=O)(O)O
StdInChI
InChI=1S/C24H40N7O18P3S/c1-12(32)23(37)53-7-6-26-14(33)4-5-27-21(36)18(35)24(2,3)9-46-52(43,44)49-51(41,42)45-8-13-17(48-50(38,39)40)16(34)22(47-13)31-11-30-15-19(25)28-10-29-20(15)31/h10-13,16-18,22,32,34-35H,4-9H2,1-3H3,(H,26,33)(H,27,36)(H,41,42)(H,43,44)(H2,25,28,29)(H2,38,39,40)/t12?,13-,16-,17-,18+,22-/m1/s1
StdInChIKey
VIWKEBOLLIEAIL-FBMOWMAESA-N
Molecular Formula
C24H40N7O18P3S
Molecular Weight
839.597
Properties
Appearance
White powder
Safety Data
RIDADR
NONH for all modes of transport
WGK Germany
3
Specifications and Other Information of Our Coenzyme A, s-(2-hydroxypropanoate) CAS 1926-57-4
Identification Methods
HNMR, HPLC
Purity
98% min
Shelf Life
2 years
Storage
Under room temperature away from light
Known Application
Ligand used in a synthesis of heterocycles by palladium-catalyzed C-N cross coupling of 3-bromothiophenes with 2-aminopyridines. Also used in a ruthenium-catalyzed alkylation of active methylene compounds with alcohols. Metal chelating ligand for catalysis.
Links
This product is developed by our R&D company Watson Bio Ltd (https://www.watson-bio.com/).
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