Products 1383119-39-8

CAS 1383119-39-8 appears in our catalog under these names: 2–hydroxyisobutyryl–CoA, 2-Hydroxyisobutyryl-CoA, 99.97%. Offered by: GLPBio, MedChemExpress. Available pack sizes: 50mg, 10 mg, 5 mg, 50 mg, 25 mg, 1 mg.

2–hydroxyisobutyryl–CoA
GLPBio
  • size: 50mg
  • Variants: 1
from 14456.00
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2-Hydroxyisobutyryl-CoA, 99.97%
MedChemExpress
  • size: 10 mg, 5 mg, 50 mg, 25 mg
  • Variants: 5
from 2952.84
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Structural formula: {0} (CAS {1})

S-[2-[3-[[(2R)-4-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-hydroxy-2-methylpropanethioate (CAS 1383119-39-8) is a chemical compound with the molecular formula C25H42N7O18P3S and a molecular weight of 853.6 g/mol. IUPAC name: S-[2-[3-[[(2R)-4-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-hydroxy-2-methylpropanethioate. InChIKey: FFVUICCDNWZCRC-NIHWKUNHSA-N.

Identity
Molecular formulaC25H42N7O18P3S
Molecular weight853.6 g/mol
IUPAC nameS-[2-[3-[[(2R)-4-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-hydroxy-2-methylpropanethioate
InChIKeyFFVUICCDNWZCRC-NIHWKUNHSA-N
SMILESCC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1C([C@@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)C(C)(C)O)O

Computed by PubChem (NCBI)

Isomers (same molecular formula)
S-[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]ethyl] 3-hydroxy-2-methylpropanethioate C25H42N7O18P3S