Coenzyme A, S-tetradecanoate, ammonium salt (1:3)

Catalog No. :
ACAVQT405
CAS No. :
799812-85-4
Molecular Formula :
C35H65N8O17P3S
Molecular Weight :
994.93

IUPAC Name:S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) tetradecanethioate, ammonia salt

Coenzyme A, S-tetradecanoate, ammonium salt (1:3) structure diagram
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Product Information

Product NameCoenzyme A, S-tetradecanoate, ammonium salt (1:3)
IUPAC NameS-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) tetradecanethioate, ammonia salt
MDL No.MFCD22416622
Molecular FormulaC35H65N8O17P3S
Molecular Weight994.93
SMILESO[C@@H]1[C@H](OP(O)(O)=O)[C@@H](COP(O)(OP(O)(OCC(C)([C@H](C(NCCC(NCCSC(CCCCCCCCCCCCC)=O)=O)=O)O)C)=O)=O)O[C@]1(N2C=NC3=C(N)N=CN=C23)[H].N
InChI KeyIBDHYZUIOICJEE-NXHBBHECSA-N
SynonymMyristoyl CoenzyMe A (aMMoniuM salt);14:0 Coenzyme A;MYRISTOYL COENZYME A (AMMONIUM SALT);14:0 COENZYME A;S-tetradecanoate-CoA,triammoniumsalt
CAS No.799812-85-4
PubChem CID145710295

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501

Synthetic Route by SureRoute

1. ACAVQT405 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

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    ACAVQT405799812-85-4
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2. ACAVQT405 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACAVQT405 route product structure diagram
    ACAVQT405799812-85-4
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