Tacrolimus-13C,d2, 98.36%

cas: 1356841-89-8 — see every product listed under this CAS number, including other names

Tacrolimus-13C,d2, 98.36% (CAS 1356841-89-8) is a chemical reagent available from Chemat. Available pack sizes: 1 mg. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-13756S-1 mg
cas1356841-89-8
size1 mg
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Available pack sizes

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MedChemExpress 1 mg 4318.18 Pln

properties

delivery time over 3 weeks
purity98.36%

(1R,9S,12S,13R,14S,17R,18Z,21S,23S,24R,25S,27R)-17-(3,3-dideuterio(313C)prop-2-enyl)-1,14-dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone (CAS 1356841-89-8) is a chemical compound with the molecular formula C44H69NO12 and a molecular weight of 807.0 g/mol. IUPAC name: (1R,9S,12S,13R,14S,17R,18Z,21S,23S,24R,25S,27R)-17-(3,3-dideuterio(313C)prop-2-enyl)-1,14-dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone. InChIKey: QJJXYPPXXYFBGM-OTZVSDQDSA-N.

Identity
Molecular formulaC44H69NO12
Molecular weight807.0 g/mol
IUPAC name(1R,9S,12S,13R,14S,17R,18Z,21S,23S,24R,25S,27R)-17-(3,3-dideuterio(313C)prop-2-enyl)-1,14-dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone
InChIKeyQJJXYPPXXYFBGM-OTZVSDQDSA-N
SMILES[2H][13C](=CC[C@@H]1/C=C(\C[C@@H](C[C@@H]([C@@H]2[C@H](C[C@H]([C@@](O2)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H]([C@@H]([C@H](CC1=O)O)C)/C(=C/[C@@H]4CC[C@H]([C@@H](C4)OC)O)/C)O)C)OC)OC)C)/C)[2H]

Computed by PubChem (NCBI)

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