Products 129039-81-2

CAS 129039-81-2 appears in our catalog under these names: Tacrolimus Impurity 18, Tacrolimus Impurity 24. Offered by: Chemat Brand. Available pack sizes: on request.

Tacrolimus Impurity 18
Chemat Brand
  • size: on request
  • Variants: 1
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Tacrolimus Impurity 24
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

(18Z)-1,14-dihydroxy-12-[(E)-1-(4-hydroxy-3-oxocyclohexyl)prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-17-prop-2-enyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone (CAS 129039-81-2) is a chemical compound with the molecular formula C43H65NO12 and a molecular weight of 788.0 g/mol. IUPAC name: (18Z)-1,14-dihydroxy-12-[(E)-1-(4-hydroxy-3-oxocyclohexyl)prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-17-prop-2-enyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone. InChIKey: DWMPNVBESFWLHN-KNLBXDFQSA-N.

Identity
Molecular formulaC43H65NO12
Molecular weight788.0 g/mol
IUPAC name(18Z)-1,14-dihydroxy-12-[(E)-1-(4-hydroxy-3-oxocyclohexyl)prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-17-prop-2-enyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone
InChIKeyDWMPNVBESFWLHN-KNLBXDFQSA-N
SMILESCC1CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC(=O)C(/C=C(\C1)/C)CC=C)O)C)/C(=C/C4CCC(C(=O)C4)O)/C)O)C)OC)OC

Computed by PubChem (NCBI)