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Pleuromutilin and derivatives

Description:

Mutilins with a hydroxyacetate derivative attached to the C8 carbon atom of the cyclopenta[8]annulene moiety.

Ancestors:

Organic compounds ⮕ Lipids and lipid-like molecules ⮕ Prenol lipids ⮕ Diterpenoids ⮕ Mutilane diterpenoids ⮕ Mutilin derivatives ⮕ Pleuromutilin and derivatives

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  1. Lefamulin
    Lefamulin
    CAS: 1061337-51-6 EC Number: 813-124-2 Formula: C28H45NO5S Molecular Weight: 507.73
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: L611476
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    Technical Identifiers
    IUPAC Name
    [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[(1R,2R,4R)-4-amino-2-hydroxycyclohexshow more
    SMILES
    CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)CSC4CCC(CC4O)N)C
    InChIKey
    KPVIXBKIJXZQJX-FCEONZPQSA-N
    InChI
    1S/C28H45NO5S/c1-6-26(4)14-22(34-23(32)15-35-21-8-7-18(29)13-20(21)31)27(5)16(2)9-11-28(17(3)25(26)33)12-10-19(30)24(27)28/h6,16-18,20-22,24-25,31,33Hshow more
    Synonyms
    SCHEMBL19766421 | 1061337-51-6 (free base) | EX-A3600 | AKOS040759180 | [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydro...
  2. BC-3205
    BC-3205
    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 #: B607965
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    Technical Identifiers
    SMILES
    C=C[C@]1(C)C[C@@H](OC(=O)CSC2CCCN(C2)C(=O)[C@@H](C(C)C)N)[C@]2(C)[C@H](C)CC[C@]3([C@H]([C@@H]1O)C)[C@H]2C(=O)CC3
    InChIKey
    AFYOQRIZFPJUAR-UBTCORFISA-N
    InChI
    1S/C32H52N2O5S/c1-8-30(6)16-24(31(7)20(4)11-13-32(21(5)28(30)37)14-12-23(35)27(31)32)39-25(36)18-40-22-10-9-15-34(17-22)29(38)26(33)19(2)3/h8,19-22,24show more
  3. Tiamulin Fumarate
    Tiamulin Fumarate
    CAS: 55297-96-6 EC Number: 259-581-6 PubChem CID: 23725049 Formula: C32H51NO8S Molecular Weight: 609.81
    ≥95%
    In Stock Item #: T136665
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    Technical Identifiers
    IUPAC Name
    (E)-but-2-enedioic acid;[(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[2-(diethylamshow more
    SMILES
    CCN(CC)CCSCC(=O)OC1CC(C(C(C23CCC(C1(C2C(=O)CC3)C)C)C)O)(C)C=C.C(=CC(=O)O)C(=O)O
    InChIKey
    YXQXDXAHCSEVSD-GCYNEOGWSA-N
    InChI
    1S/C28H47NO4S.C4H4O4/c1-8-26(6)17-22(33-23(31)18-34-16-15-29(9-2)10-3)27(7)19(4)11-13-28(20(5)25(26)32)14-12-21(30)24(27)28;5-3(6)1-2-4(7)8/h8,19-20,2show more
    Synonyms
    Acetic acid, ((2-(diethylamino)ethyl)thio)-, 6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH...
  4. Tiamulin Fumarate
    Tiamulin Fumarate
    CAS: 55297-96-6 EC Number: 259-581-6 PubChem CID: 23725049 Formula: C32H51NO8S Molecular Weight: 609.81
    10mM in DMSO
    Out of Stock Item #: T580541
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    Technical Identifiers
    IUPAC Name
    (E)-but-2-enedioic acid;[(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[2-(diethylamshow more
    SMILES
    CCN(CC)CCSCC(=O)OC1CC(C(C(C23CCC(C1(C2C(=O)CC3)C)C)C)O)(C)C=C.C(=CC(=O)O)C(=O)O
    InChIKey
    YXQXDXAHCSEVSD-GCYNEOGWSA-N
    InChI
    1S/C28H47NO4S.C4H4O4/c1-8-26(6)17-22(33-23(31)18-34-16-15-29(9-2)10-3)27(7)19(4)11-13-28(20(5)25(26)32)14-12-21(30)24(27)28;5-3(6)1-2-4(7)8/h8,19-20,2show more
    Synonyms
    TIAMULIN FUMARATE|Dynamutilin|Tiamulin hydrogen fumarate|Tiavet|55297-96-6|Thiamutilin fumarate|Sandoz 81723hfu|UNII-...
  5. Valnemulin HCl
    Valnemulin HCl
    CAS: 133868-46-9 EC Number: 685-606-9 PubChem CID: 60195218 Formula: C31H52N2O5S·HCl Molecular Weight: 601.28
    10mM in DMSO
    In Stock Item #: V421284
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[1-[[(2R)-2-amino-3-methylbutanoyl]amshow more
    SMILES
    CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)CSC(C)(C)CNC(=O)C(C(C)C)N)C.Cl
    InChIKey
    MFBPRQKHDIVLOJ-AFFLPQGKSA-N
    InChI
    1S/C31H52N2O5S.ClH/c1-10-29(8)15-22(38-23(35)16-39-28(6,7)17-33-27(37)24(32)18(2)3)30(9)19(4)11-13-31(20(5)26(29)36)14-12-21(34)25(30)31;/h10,18-20,22show more
    Synonyms
    Valnemulin hydrochloride|133868-46-9|Valnemulin HCl|Econor|UNII-W1GDP58BNQ|W1GDP58BNQ|Valnemulin hydrochloride [MI]|D...
  6. no_selection
    Tiamulin
    CAS: 55297-95-5 EC Number: 259-580-0 PubChem CID: 656958 Formula: C28H47NO4S Molecular Weight: 493.74
    10mM in DMSO
    In Stock Item #: T424711
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[2-(diethylamino)ethylsulfanyl]acetatshow more
    SMILES
    CCN(CC)CCSCC(=O)OC1CC(C(C(C23CCC(C1(C2C(=O)CC3)C)C)C)O)(C)C=C
    InChIKey
    UURAUHCOJAIIRQ-QGLSALSOSA-N
    InChI
    1S/C28H47NO4S/c1-8-26(6)17-22(33-23(31)18-34-16-15-29(9-2)10-3)27(7)19(4)11-13-28(20(5)25(26)32)14-12-21(30)24(27)28/h8,19-20,22,24-25,32H,1,9-18H2,2-show more
    Synonyms
    ((2-(Diethylamino)Ethyl)Thio)-, 6-Ethenyldecahydro-5-Hydroxy-4,6,9,10-Tetramethyl-1-Oxo-3a,9-Propano-3aH-Cyclopentacy...
  7. Tiamulin - analytical standard CAS No(55297-95-5) by Aladdin Scientific
    Tiamulin
    CAS: 55297-95-5 EC Number: 259-580-0 PubChem CID: 656958 Formula: C28H47NO4S Molecular Weight: 493.74
    Solid Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    In Stock Item #: T114325
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    Technical Identifiers
    IUPAC Name
    [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[2-(diethylamino)ethylsulfanyl]acetatshow more
    SMILES
    CCN(CC)CCSCC(=O)OC1CC(C(C(C23CCC(C1(C2C(=O)CC3)C)C)C)O)(C)C=C
    InChIKey
    UURAUHCOJAIIRQ-QGLSALSOSA-N
    InChI
    1S/C28H47NO4S/c1-8-26(6)17-22(33-23(31)18-34-16-15-29(9-2)10-3)27(7)19(4)11-13-28(20(5)25(26)32)14-12-21(30)24(27)28/h8,19-20,22,24-25,32H,1,9-18H2,2-show more
    Synonyms
    ((2-(Diethylamino)Ethyl)Thio)-, 6-Ethenyldecahydro-5-Hydroxy-4,6,9,10-Tetramethyl-1-Oxo-3a,9-Propano-3aH-Cyclopentacy...
  8. Pleuromutilin - ≥95% CAS No(125-65-5) by Aladdin Scientific
    Pleuromutilin
    CAS: 125-65-5 EC Number: 204-747-5 PubChem CID: 46782767 Formula: C22H34O5 Molecular Weight: 378.51
    ≥95%
    In Stock Item #: P329427
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    [(2R,3S,4S,6R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-hydroxyacetate
    SMILES
    CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)CO)C
    InChIKey
    ZRZNJUXESFHSIO-JKZASVEESA-N
    InChI
    1S/C22H34O5/c1-6-20(4)11-16(27-17(25)12-23)21(5)13(2)7-9-22(14(3)19(20)26)10-8-15(24)18(21)22/h6,13-14,16,18-19,23,26H,1,7-12H2,2-5H3/t13-,14+,16-,18+show more
    Synonyms
    PLEUROMULIN | (3aS,4R,5S,6S,8R,9R,9aR,12R)-5-Hydroxy-4,6,9,12-tetramethyl-1-oxo-6-vinyldecahydro-3a,9-propanocyclopen...
  9. Pleuromutilin
    Pleuromutilin
    CAS: 125-65-5 EC Number: 204-747-5 PubChem CID: 46782767 Formula: C22H34O5 Molecular Weight: 378.51
    10mM in DMSO
    In Stock Item #: P421076
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    [(2R,3S,4S,6R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-hydroxyacetate
    SMILES
    CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)CO)C
    InChIKey
    ZRZNJUXESFHSIO-JKZASVEESA-N
    InChI
    1S/C22H34O5/c1-6-20(4)11-16(27-17(25)12-23)21(5)13(2)7-9-22(14(3)19(20)26)10-8-15(24)18(21)22/h6,13-14,16,18-19,23,26H,1,7-12H2,2-5H3/t13-,14+,16-,18+show more
    Synonyms
    PLEUROMULIN | (3aS,4R,5S,6S,8R,9R,9aR,12R)-5-Hydroxy-4,6,9,12-tetramethyl-1-oxo-6-vinyldecahydro-3a,9-propanocyclopen...
  10. Lefamulin acetate (Xenleta)
    Lefamulin acetate (Xenleta)
    CAS: 1350636-82-6 EC Number: 695-920-8 PubChem CID: 86346053 Formula: C3OH49NO7S Molecular Weight: 567.78
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: L412984
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    Technical Identifiers
    IUPAC Name
    acetic acid;[(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[(1R,2R,4R)-4-amino-2-hydshow more
    SMILES
    CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)CSC4CCC(CC4O)N)C.CC(=O)O
    InChIKey
    WSMXIQXWHPSVDE-ZPJPNJFZSA-N
    InChI
    1S/C28H45NO5S.C2H4O2/c1-6-26(4)14-22(34-23(32)15-35-21-8-7-18(29)13-20(21)31)27(5)16(2)9-11-28(17(3)25(26)33)12-10-19(30)24(27)28;1-2(3)4/h6,16-18,20-show more
    Synonyms
    BC-3781 acetate | DTXSID801027897 | AT18250 | Lefamulinacetate | Q27279882 | D11632 | MS-30273 | Lefamulin (acetate) ...
  11. Valnemulin HCl
    Valnemulin HCl
    CAS: 133868-46-9 PubChem CID: 60195218 Formula: C31H52N2O5S·HCl Molecular Weight: 601.28
    ≥95%
    In Stock Item #: V129592
    View Product
    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[1-[[(2R)-2-amino-3-methylbutanoyl]amshow more
    SMILES
    CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)CSC(C)(C)CNC(=O)C(C(C)C)N)C.Cl
    InChIKey
    MFBPRQKHDIVLOJ-AFFLPQGKSA-N
    InChI
    1S/C31H52N2O5S.ClH/c1-10-29(8)15-22(38-23(35)16-39-28(6,7)17-33-27(37)24(32)18(2)3)30(9)19(4)11-13-31(20(5)26(29)36)14-12-21(34)25(30)31;/h10,18-20,22show more
    Synonyms
    DTXSID30158407 | Acetic acid, 2-[[2-[[(2R)-2-amino-3-methyl-1-oxobutyl]amino]-1,1-dimethylethyl]thio]-, (3aS,4R,5S,6S...
  12. Retapamulin
    Retapamulin
    CAS: 224452-66-8 PubChem CID: 6918462 Formula: C30H47NO4S Molecular Weight: 517.76
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
    In Stock Item #: R125875
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[[(1R,5S)-8-methyl-8-azabicyclo[3.2.1show more
    SMILES
    CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)CSC4CC5CCC(C4)N5C)C
    InChIKey
    STZYTFJPGGDRJD-FJJJPKKESA-N
    InChI
    1S/C30H47NO4S/c1-7-28(4)16-24(35-25(33)17-36-22-14-20-8-9-21(15-22)31(20)6)29(5)18(2)10-12-30(19(3)27(28)34)13-11-23(32)26(29)30/h7,18-22,24,26-27,34Hshow more
    Synonyms
    DTXSID30181492 | HY-17010 | Altargo | RETAPAMULIN [MI] | RETAPAMULIN [INN] | (3aS,4R,5S,6S,8R,9R,9aR,10R)-2-(exo-8-Me...
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