Acyl CoAs

Description:

Organic compounds containing a coenzyme A substructure linked to an acyl chain.

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  1. cyclohexane-1-carbonyl-CoA
    CAS: 5960-12-3 Formula: C28H46N7O17P3S Molecular Weight: 877.700
    Out of Stock Item #: C1020417
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    IUPAC Name
    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-hydrshow more
    SMILES
    CC(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)[C@H](C(=O)NCCC(=O)NCCSC(=O)C4CCCCC4)O
    InChIKey
    QRSKGVRHSLILFG-TYHXJLICSA-N
    InChI
    1S/C28H46N7O17P3S/c1-28(2,22(38)25(39)31-9-8-18(36)30-10-11-56-27(40)16-6-4-3-5-7-16)13-49-55(46,47)52-54(44,45)48-12-17-21(51-53(41,42)43)20(37)26(50show more
  2. Pimeloyl-coa
    CAS: 18907-20-5 Formula: C28H46N7O19P3S Molecular Weight: 909.7
    Out of Stock Item #: P1298044
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    IUPAC Name
    7-[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-hydrshow more
    SMILES
    CC(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)[C@H](C(=O)NCCC(=O)NCCSC(=O)CCCCCC(=O)O)O
    InChIKey
    LYCRXMTYUZDUGA-UYRKPTJQSA-N
    InChI
    1S/C28H46N7O19P3S/c1-28(2,23(41)26(42)31-9-8-17(36)30-10-11-58-19(39)7-5-3-4-6-18(37)38)13-51-57(48,49)54-56(46,47)50-12-16-22(53-55(43,44)45)21(40)27show more
  3. propionyl-CoA
    CAS: 317-66-8 PubChem CID: 92753
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: P612947
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    IUPAC Name
    {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-[(2-{[2-(propanoylsulfanyl)ethyl]carbamoyl}ethshow more
    SMILES
    CCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(COP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O
    InChIKey
    QAQREVBBADEHPA-IEXPHMLFSA-N
    InChI
    1S/C24H40N7O17P3S/c1-4-15(33)52-8-7-26-14(32)5-6-27-22(36)19(35)24(2,3)10-45-51(42,43)48-50(40,41)44-9-13-18(47-49(37,38)39)17(34)23(46-13)31-12-30-16show more
    Synonyms
    4,6-Dichloro-2-methylsulfanylpyrimidine-5-carboxaldehyde | p-cresyl sulphate | C00100 | LMFA07050364 | UNII-H7HQA57V5...
  4. methylmalonyl-CoA
    CAS: 1264-45-5 PubChem CID: 123909
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: M611833
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    IUPAC Name
    3-[(2-{3-[(2R)-3-[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoshow more
    SMILES
    O=C(NCCSC(=O)C(C(=O)O)C)CCNC(=O)[C@@H](C(COP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O
    InChIKey
    MZFOKIKEPGUZEN-FBMOWMAESA-N
    InChI
    1S/C25H40N7O19P3S/c1-12(23(37)38)24(39)55-7-6-27-14(33)4-5-28-21(36)18(35)25(2,3)9-48-54(45,46)51-53(43,44)47-8-13-17(50-52(40,41)42)16(34)22(49-13)32show more
    Synonyms
    3-[(2-{3-[(2R)-3-[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydrox...
  5. [¹⁴C]acetylCoA
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: C614001
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    IUPAC Name
    {[(2R,3S,4R,5R)-2-({[({[(3R)-3-{[2-({2-[(1-14C)acetylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phospshow more
    SMILES
    O=C(NCCS[14C](=O)C)CCNC(=O)[C@@H](C(COP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O
    InChIKey
    ZSLZBFCDCINBPY-YHBLMJDYSA-N
    InChI
    1S/C23H38N7O17P3S/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15-19show more
    Synonyms
    [¹⁴C]-acetylCoA
  6. (S)-3-hydroxy-3-methylglutaryl-CoA
    CAS: 26926-09-0 PubChem CID: 445127
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: S613376
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    IUPAC Name
    (3S)-5-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2show more
    SMILES
    O=C(NCCSC(=O)C[C@](CC(=O)O)(O)C)CCNC(=O)[C@@H](C(COP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O
    InChIKey
    CABVTRNMFUVUDM-VRHQGPGLSA-N
    InChI
    1S/C27H44N7O20P3S/c1-26(2,21(40)24(41)30-5-4-15(35)29-6-7-58-17(38)9-27(3,42)8-16(36)37)11-51-57(48,49)54-56(46,47)50-10-14-20(53-55(43,44)45)19(39)25show more
    Synonyms
    S-(Hydrogen 3-hydroxy-3-methylglutaryl)coenzyme A | S-(Hydrogen 3-hydroxy-3-methylpentanedioate | SCHEMBL1198 | S-(Hy...
  7. Acetyl-Coenzyme A trilithium salt
    CAS: 75520-41-1 EC Number: 200-790-9 Formula: C23H35Li3N7O17P3S Molecular Weight: 827.37
    85% (Enzymatic and Absorbance), 2% (lithium)
    In Stock Item #: A466839
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    IUPAC Name
    trilithium;[(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxishow more
    SMILES
    [Li+].[Li+].[Li+].CC(=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
    InChIKey
    FTRFBNATWBKIQU-JHJDYNLLSA-K
    InChI
    1S/C23H38N7O17P3S.3Li/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-1show more
    Synonyms
    DTXSID70585056 | trilithium;[(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy...
  8. Acetyl coenzyme A lithium salt
    CAS: 32140-51-5 Formula: C23H38N7O17P3S · xLi+ Molecular Weight: 809.57 (free acid basis)
    In Stock Item #: A432621
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    Technical Identifiers
    IUPAC Name
    trilithium;[(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxishow more
    SMILES
    [Li+].[Li+].[Li+].CC(=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
    InChIKey
    FTRFBNATWBKIQU-JHJDYNLLSA-K
    InChI
    1S/C23H38N7O17P3S.3Li/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-1show more
    Synonyms
    Acetyl-CoA, Acetyl-S-CoA Li₃
  9. Acetyl coenzyme A sodium salt
    CAS: 102029-73-2 PubChem CID: 16218868 Formula: C23H38N7O17P3S·xNa Molecular Weight: 809.57(free)
    Solid ≥90%
    In Stock Item #: A463299
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    Technical Identifiers
    SMILES
    CC(=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.[Na]
    InChIKey
    XGCDESRMLMCTPI-UHFFFAOYSA-N
    InChI
    1S/C23H38N7O17P3S.Na/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15show more
    Synonyms
    Acetyl CoA | Acetyl-S- CoA
  10. Malonyl coenzyme A lithium salt
    CAS: 108347-84-8 Formula: C24H38N7O19P3S • XLi Molecular Weight: 853.58 (free acid basis)
    In Stock Item #: M463170
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    Technical Identifiers
    SMILES
    [Li].CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC(=O)O)O
    InChIKey
    OPIJLICRFQMMJH-UHFFFAOYSA-N
    InChI
    1S/C24H38N7O19P3S.Li/c1-24(2,19(37)22(38)27-4-3-13(32)26-5-6-54-15(35)7-14(33)34)9-47-53(44,45)50-52(42,43)46-8-12-18(49-51(39,40)41)17(36)23(48-12)31show more
    Synonyms
    CID 16219642 | AKOS030255405 | DTXSID70585218 | Malonyl coenzyme A lithium salt | PUBCHEM_16219642
  11. n-Heptadecanoyl coenzyme A lithium salt
    CAS: 3546-17-6 Formula: C38H68N7O17P3S Molecular Weight: 1019.97
    Solid ≥90%
    Out of Stock Item #: N463142
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    Technical Identifiers
    IUPAC Name
    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-hydrshow more
    SMILES
    CCCCCCCCCCCCCCCCC(=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
    InChIKey
    DRABUZIHHACUPI-DUPKZGIXSA-N
    InChI
    1S/C38H68N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29(47)66-22-21-40-28(46)19-20-41-36(50)33(49)38(2,3)24-59-65(56,57)62-64(54,55)58-23-27-32show more
    Synonyms
    n-Heptadecanoic acid coenzyme a | Heptadecanoyl-coenzyme A | Heptadecyl-coenzyme A | s-Heptadecanoyl coenzyme A | Hep...
  12. Acetyl coenzyme A lithium salt
    CAS: 32140-51-5 Formula: C23H38N7O17P3S · xLi+ Molecular Weight: 809.57 (free acid basis)
    In Stock Item #: A113381
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    Technical Identifiers
    IUPAC Name
    trilithium;[(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxishow more
    SMILES
    [Li+].[Li+].[Li+].CC(=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
    InChIKey
    FTRFBNATWBKIQU-JHJDYNLLSA-K
    InChI
    1S/C23H38N7O17P3S.3Li/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-1show more
    Synonyms
    DTXSID70585056 | trilithium;[(2R,3S,4R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy...
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