18:1 (N12) Coenzyme A

cas: 70954-87-9 — see every product listed under this CAS number, including other names

18:1 (N12) Coenzyme A (CAS 70954-87-9) is a chemical reagent available from Chemat. Available pack sizes: 25mg, 10mg, 50mg, 5MG. Offered by: Biosynth, Sigma-Aldrich.

brandBiosynth
catalog numberVCA95487-25mg
cas70954-87-9
size25mg
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Available pack sizes

brand size price
Biosynth 25mg price on request
Biosynth 10mg price on request
Biosynth 50mg price on request
Sigma-Aldrich 5MG 1970.00 Pln

properties

categoryLife Sciences
sub-category 1Ligands
purityNo data
delivery time3-4 Weeks
Structural formula: {0} (CAS {1})

Triazanium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[2-[(Z)-octadec-6-enoyl]sulfanylethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate (CAS 70954-87-9) is a chemical compound with the molecular formula C39H77N10O17P3S and a molecular weight of 1083.1 g/mol. IUPAC name: triazanium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[2-[(Z)-octadec-6-enoyl]sulfanylethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate. InChIKey: MWMWRTNFCHQAGB-GFCZCHAHSA-N.

Identity
Molecular formulaC39H77N10O17P3S
Molecular weight1083.1 g/mol
IUPAC nametriazanium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[2-[(Z)-octadec-6-enoyl]sulfanylethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate
InChIKeyMWMWRTNFCHQAGB-GFCZCHAHSA-N
SMILESCCCCCCCCCCC/C=C\CCCCC(=O)SCCNC(=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.[NH4+].[NH4+].[NH4+]

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] (Z)-octadec-11-enethioate;azane C39H77N10O17P3S

Also listed as

(6Z-Octadecenoyl)-CoA MedChemExpress CAS 70954-87-9