(2R)-Sulfonatepropionyl-amino(dethia)-CoA

cas: 2396507-34-7 — see every product listed under this CAS number, including other names

(2R)-Sulfonatepropionyl-amino(dethia)-CoA (CAS 2396507-34-7) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas2396507-34-7
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Structural formula: {0} (CAS {1})

(2S)-1-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylamino]-1-oxopropane-2-sulfonic acid (CAS 2396507-34-7) is a chemical compound with the molecular formula C24H41N8O20P3S and a molecular weight of 886.6 g/mol. IUPAC name: (2S)-1-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylamino]-1-oxopropane-2-sulfonic acid. InChIKey: IUFNAUQYWOGJPI-CLSLWNEHSA-N.

Identity
Molecular formulaC24H41N8O20P3S
Molecular weight886.6 g/mol
IUPAC name(2S)-1-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylamino]-1-oxopropane-2-sulfonic acid
InChIKeyIUFNAUQYWOGJPI-CLSLWNEHSA-N
SMILESC[C@@H](C(=O)NCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O)S(=O)(=O)O

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