TAUROCHENODEOXYCHOLIC ACID-D4, SODIUM SA

cas: 2410279-85-3 — see every product listed under this CAS number, including other names

TAUROCHENODEOXYCHOLIC ACID-D4, SODIUM SA (CAS 2410279-85-3) is a chemical reagent available from Chemat. Available pack sizes: 1MG. Offered by: Sigma-Aldrich.

brandSigma-Aldrich
catalog number330274P-1MG
cas2410279-85-3
size1MG
availability availability
Documents: Safety Data Sheet (MSDS)
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Available pack sizes

brand size price
Sigma-Aldrich 1MG 1101.00 Pln

properties

purityNo data
delivery time1-2 weeks (only if in stock, to check click on availability)
Structural formula: {0} (CAS {1})

Sodium 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-2,2,4,4-tetradeuterio-3,7-dihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate (CAS 2410279-85-3) is a chemical compound with the molecular formula C26H44NNaO6S and a molecular weight of 525.7 g/mol. IUPAC name: sodium 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-2,2,4,4-tetradeuterio-3,7-dihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate. InChIKey: IYPNVUSIMGAJFC-SWZNJHJNSA-M.

Identity
Molecular formulaC26H44NNaO6S
Molecular weight525.7 g/mol
IUPAC namesodium 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-2,2,4,4-tetradeuterio-3,7-dihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate
InChIKeyIYPNVUSIMGAJFC-SWZNJHJNSA-M
SMILES[2H]C1(C[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3[C@@H](C[C@@H]2C([C@@H]1O)([2H])[2H])O)CC[C@@H]4[C@H](C)CCC(=O)NCCS(=O)(=O)[O-])C)C)[2H].[Na+]

Computed by PubChem (NCBI)

Synonyms: Taurochenodeoxycholic Acid-d4 (sodium salt), Taurochenodeoxycholic acid-d4 sodium, Taurochenodeoxycholic acid D4 (sodium), Taurochenodeoxycholic acid-d4 (sodium), Taurochenodeoxycholic Acid Sodium Salt-D4
Related forms of this compound
sodium 2-[[(4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate C26H44NNaO6S
sodium 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate C26H44NNaO6S
Isomers (same molecular formula)
sodium 2-[[(4R)-4-[(3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate C26H44NNaO6S
sodium 2-[[(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate C26H44NNaO6S

Also listed as

Taurochenodeoxycholic Acid–d4 (sodium salt) GLPBio CAS 2410279-85-3
Taurochenodeoxycholic acid-d4 sodium Biosynth CAS 2410279-85-3
Taurochenodeoxycholic acid-d4 (sodium), 99.20% MedChemExpress CAS 2410279-85-3