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Structure

Propionyl coenzyme a lithium salt

CAS
108321-21-7
Catalog Number
ACM108321217
Category
Other Products
Molecular Weight
829.60
Molecular Formula
C24H39N7O17P3SLi

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Specification

Synonyms
S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tet rahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphor yl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethyl ] propanethioate,lithium;
IUPAC Name
lithium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-propanoylsulfanylethylamino)propyl]amino]butoxy]phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl]hydrogenphosphate
Canonical SMILES
[Li+].CCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)[O-])O
InChI Key
NHDDMVHJPMKFOA-UIXOMBANSA-M
Appearance
White powder
Exact Mass
830.15700
Hazard Statements
Xi: Irritant;
Safety Description
22-26-36
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