Products 116380-66-6

CAS 116380-66-6 appears in our catalog under these names: Cholic Acid-d4, >95% (HPLC), Cholic-2,2,4,4-d4 Acid, 98 atom % D, min 98% Chemical Purity, Cholic Acid–d4, Cholic acid-d4, CHOLIC ACID-2,2,4,4-D4, 98 ATOM % D, 98&. Offered by: TRC, CDN, GLPBio, TargetMol, Biosynth. Available pack sizes: 10mg, 50mg, 5mg, 0,1g, 0,05g, 1mg, 100mg, 25mg.

Cholic Acid-d4, >95% (HPLC)
TRC
  • size: 10mg, 50mg, 5mg
  • Variants: 3
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Cholic-2,2,4,4-d4 Acid, 98 atom % D, min 98% Chemical Purity
CDN
  • size: 0,1g, 0,05g
  • Variants: 2
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Cholic Acid–d4
GLPBio
  • size: 1mg, 10mg, 5mg
  • Variants: 3
from 709.37
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Cholic acid-d4
TargetMol, Biosynth, Sigma-Aldrich
  • size: 100mg, 10mg, 25mg, 50mg
  • Variants: 5
from 828.00
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CHOLIC ACID-2,2,4,4-D4, 98 ATOM % D, 98&
Sigma-Aldrich
  • size: 500MG
  • Variants: 1
from 10283.00
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Cholic acid-d4, 99.91%
MedChemExpress
  • size: 1 mg, 25 mg, 5 mg, 10 mg
  • Variants: 6
from 454.37
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Structural formula: {0} (CAS {1})

Cholic acid-2,2,4,4-d4 is a bile acid.

Source: ChEBI

Identity
Molecular formulaC24H40O5
Molecular weight412.6 g/mol
IUPAC name(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-2,2,4,4-tetradeuterio-3,7,12-trihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
InChIKeyBHQCQFFYRZLCQQ-YFEOEUIKSA-N
SMILES[2H]C1(C[C@@]2([C@H]3C[C@@H]([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)O)C)O)C)[2H]

Computed by PubChem (NCBI)

Synonyms: Cholic acid-2,2,4,4-d4, Cholic acid 2,2,4,4-D4, cholic acid-d4, CA_d4, Cholic acid-2,2,4,4-d?, orb2280988, cholic acid (2,2,4,4-D4), Cholic Acid-d4 MaxSpec(R) Standard, Cholic acid-2,2,4,4-d4, 98 atom % D, 98% (CP), Cholic acid-D4, 100 mug/mL in methanol, certified reference material
Related forms of this compound
(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 C24H40O5
(4R)-4-[(3R,5S,7S,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 C24H40O5
(4R)-4-[(3S,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 C24H40O5
(4R)-4-[(3R,5S,7R,8R,9S,10S,12R,13R,14S,17R)-3,7,12-trihydroxy-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 C24H40O5
(4R)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 C24H40O5
(4R)-4-[(3R,5S,7S,8R,9S,10S,12R,13R,14S,17R)-3,7,12-trihydroxy-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 C24H40O5
(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl](113C)pentanoic acid C24H40O5
(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3,7,12-trihydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O5
Isomers (same molecular formula)
methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E,4R)-4-hydroxy-4-(1-propylcyclobutyl)but-1-enyl]-5-oxocyclopentyl]heptanoate C24H40O5
(4R)-4-[(3R,5R,6R,7S,8S,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-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 C24H40O5
(4R)-4-[(3S,5R,6R,8S,9S,10R,13R,14S,17R)-3,5,6-trihydroxy-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid C24H40O5
(4R)-4-[(1R,3S,5R,8S,9S,10S,12S,13R,14S,17R)-1,3,12-trihydroxy-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 C24H40O5