Lithocholic Acid-d4, >95% (HPLC)

cas: 83701-16-0 — see every product listed under this CAS number, including other names

Lithocholic Acid-d4, >95% (HPLC) (CAS 83701-16-0) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 2,5mg, 25mg. Offered by: TRC.

brandTRC
catalog numberTRC-L469182-1MG
cas83701-16-0
size1mg
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Available pack sizes

brand size price
TRC 1mg price on request
TRC 2,5mg price on request
TRC 25mg price on request

properties

purity>95% (HPLC)
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

Lithocholic acid-2,2,4,4-d4 is a lithocholic acid and a deuterated compound.

Source: ChEBI

Identity
Molecular formulaC24H40O3
Molecular weight380.6 g/mol
IUPAC name(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-2,2,4,4-tetradeuterio-3-hydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
InChIKeySMEROWZSTRWXGI-POXZWENPSA-N
SMILES[2H]C1(C[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC[C@@H]2C([C@@H]1O)([2H])[2H])CC[C@@H]4[C@H](C)CCC(=O)O)C)C)[2H]

Computed by PubChem (NCBI)

Synonyms: (3alpha,5beta)-3-Hydroxycholan-24-oic-2,2,4,4-d4 acid, Lithocholic Acid-d4, Lithocholic acid-2,2,4,4-d4, Lithocholic-2,2,4,4-d4 acid, lithocholicacid-2,2,4,4-d4, orb2299709, Lithocholic Acid-d4 MaxSpec(R) Standard, Lithocholic acid-2,2,4,4-d4, 98 atom % D, 3alpha-Hydroxy(2,2,4,4-~2~H_4_)-5beta-cholan-24-oic acid, (3alpha,5beta)-3-Hydroxy(2,2,4,4-~2~H_4_)cholan-24-oic acid
Related forms of this compound
(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3-hydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
(4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
(4R)-4-[(3S,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
(4R)-2,2-dideuterio-4-[(3S,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
(4R)-4-[(3S,5S,8R,9S,10S,13R,14S,17R)-2,2,4,4-tetradeuterio-3-hydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
Isomers (same molecular formula)
(4R)-4-[(5S,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
(4R)-4-[(5S,8R,9S,10S,12R,13R,14S,17R)-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
(4R)-4-[(5S,7S,8R,9S,10S,13R,14S,17R)-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O3
2-[(1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl]-5-(2-methyloctan-2-yl)phenol C24H40O3
2-[5-hydroxy-2-(3-hydroxypropyl)cyclohexyl]-5-(2-methyloctan-2-yl)phenol C24H40O3

Also listed as

Lithocholic-2,2,4,4-d4 Acid Chemat Brand CAS 83701-16-0
Lithocholic-2,2,4,4-d4 Acid, 98 atom % D, min 98% Chemical Purity CDN CAS 83701-16-0
Lithocholic Acid–d4 GLPBio CAS 83701-16-0
Lithocholic acid-2,2,4,4-d4 Biosynth CAS 83701-16-0
LITHOCHOLIC ACID-D4 Sigma-Aldrich CAS 83701-16-0
Lithocholic acid-d4, 99.91% MedChemExpress CAS 83701-16-0