(Q104193218)

English

[7,7-Dichloro-1-[2-hydroxy-1-(4-methoxycarbonyl-1,3-thiazol-2-yl)-2-methylpropoxy]-2-methyl-1-oxooctan-3-yl] 2-[2-[4-(butanoylamino)-3-hydroxy-6-methylheptanoyl]oxy-1-hydroxyethyl]-1,3-thiazole-4-carboxylate

group of stereoisomers with the chemical formula C₃₆H₅₃Cl₂N₃O₁₂S₂

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instance of

group of stereoisomers

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1 reference

853.2447714960003 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₆H₅₃Cl₂N₃O₁₂S₂

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canonical SMILES

CCCC(=O)NC(CC(C)C)C(O)CC(=O)OCC(O)c1nc(C(=O)OC(CCCC(C)(Cl)Cl)C(C)C(=O)OC(c2nc(C(=O)OC)cs2)C(C)(C)O)cs1

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Identifiers

InChI

InChI=1S/C36H53Cl2N3O12S2/c1-9-11-27(44)39-21(14-19(2)3)24(42)15-28(45)51-16-25(43)30-40-23(18-54-30)34(48)52-26(12-10-13-36(7,37)38)20(4)32(46)53-29(35(5,6)49)31-41-22(17-55-31)33(47)50-8/h17-21,24-26,29,42-43,49H,9-16H2,1-8H3,(H,39,44)

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InChIKey

OBWCQUXEFAKVED-UHFFFAOYSA-N

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PubChem CID

162815771

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

OBWCQUXEFAKVED-UHFFFAOYSA-N

(Q104193218)

[7,7-Dichloro-1-[2-hydroxy-1-(4-methoxycarbonyl-1,3-thiazol-2-yl)-2-methylpropoxy]-2-methyl-1-oxooctan-3-yl] 2-[2-[4-(butanoylamino)-3-hydroxy-6-methylheptanoyl]oxy-1-hydroxyethyl]-1,3-thiazole-4-carboxylate

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