Products 1246304-40-4

CAS 1246304-40-4 appears in our catalog under these names: Coenzyme A, S-(10Z)-10-heptadecenoate, ammonium salt (1:3), 98%, 17:1 (N7) COENZYME A, 17:1(n7) Coenzyme A (triammonium). Offered by: Chemat Brand, Sigma-Aldrich, MedChemExpress. Available pack sizes: on request, 5MG, 1 mg.

Structural formula: {0} (CAS {1})

S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-heptadec-10-enethioate;azane (CAS 1246304-40-4) is a chemical compound with the molecular formula C38H69N8O17P3S and a molecular weight of 1035.0 g/mol. IUPAC name: S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-heptadec-10-enethioate;azane. InChIKey: PHTCXSGLMAPSSA-RRABGKBLSA-N.

Identity
Molecular formulaC38H69N8O17P3S
Molecular weight1035.0 g/mol
IUPAC nameS-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-heptadec-10-enethioate;azane
InChIKeyPHTCXSGLMAPSSA-RRABGKBLSA-N
SMILESCCCCCC/C=C/CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O.N

Computed by PubChem (NCBI)