Dehydrocholic acid, 95%

cas: 81-23-2 — see every product listed under this CAS number, including other names

Dehydrocholic acid, 95% (CAS 81-23-2) is a chemical reagent available from Chemat. Available pack sizes: 1g, 5g, 25g, 100g, 1mg, 500g. Offered by: Combi-blocks, Fluorochem, Ambeed.

brandCombi-blocks
catalog numberQJ-1582-1g
cas81-23-2
size1g
Documents: Safety Data Sheet (MSDS)
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Available pack sizes

brand size price
Combi-blocks 1g price on request
Combi-blocks 5g price on request
Combi-blocks 25g price on request
Fluorochem 100g 1023.62 Pln
Ambeed 1mg 153.44 Pln
Ambeed 1g 175.69 Pln
Ambeed 5g 197.94 Pln
Ambeed 25g 320.31 Pln
Ambeed 100g 993.38 Pln
Ambeed 500g 3774.62 Pln

properties

purity95%
delivery time1-2 weeks (only if in stock, to check click on availability)
Structural formula: {0} (CAS {1})

3,7,12-trioxo-5beta-cholanic acid is an oxo-5beta-cholanic acid in which three oxo substituents are located at positions 3, 7 and 12 on the cholanic acid skeleton. It has a role as a gastrointestinal drug. It is a 3-oxo-5beta-steroid, an oxo-5beta-cholanic acid, a 7-oxo steroid and a 12-oxo steroid. It is a conjugate acid of a 3,7,12-trioxo-5beta-cholan-24-oate.

Source: ChEBI

Identity
Molecular formulaC24H34O5
Molecular weight402.5 g/mol
IUPAC name(4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7,12-trioxo-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
InChIKeyOHXPGWPVLFPUSM-KLRNGDHRSA-N
SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CCC(=O)C4)C)C

Computed by PubChem (NCBI)

Synonyms: dehydrocholic acid, Decholin, Dilabil, Procholon, Ketocholanic acid, Triketocholanic acid, 3,7,12-Trioxocholanic acid, 3,7,12-Triketocholanic acid, 3,7,12-Trioxo-5beta-cholan-24-oic acid, 3,7,12-Triketo-5beta-cholanoic acid
Isomers (same molecular formula)
[(1R,6S,8R,9S,10R,13S,14S,17R)-17-acetyl-1-hydroxy-6,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate C24H34O5
methyl (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]hept-5-enoate C24H34O5
[(2S,6S,8R,9S,10R,13S,14S,17R)-17-acetyl-2-hydroxy-6,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate C24H34O5
[(8R,9S,10R,13S,14S,17R)-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate C24H34O5
[2-[(8R,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate C24H34O5
[(6R,8R,9S,10R,13S,14S,17R)-17-acetyl-6-hydroxy-6,10,13-trimethyl-3-oxo-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate C24H34O5
[(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6-hydroxy-6,10,13-trimethyl-3-oxo-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate C24H34O5
[(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (E)-2-methylbut-2-enoate C24H34O5
(13S,17R)-13-methyl-17-(2-methyl-1,3-dioxolan-2-yl)spiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol C24H34O5
(8S,13S,14S,17S)-13-methyl-17-(2-methyl-1,3-dioxolan-2-yl)spiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol C24H34O5
[(1S,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-3-methylidene-2,7,8,8a-tetrahydro-1H-naphthalen-1-yl] (2S)-2-methylbutanoate C24H34O5
(4R,6'R,8'R,9'S,10'R,13'S,14'S)-6'-hydroxy-2,2,10',13'-tetramethylspiro[1,3-dioxane-4,17'-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-3',5-dione C24H34O5

Also listed as

Dehydrocholic Acid Chemat Brand CAS 81-23-2
Dehydrocholic Acid, >95% (HPLC) TRC CAS 81-23-2
Dehydrocholic acid/ 95.14% (existing batch purity) TargetMol CAS 81-23-2
Dehydrocholic acid, 99% Thermo Scientific (Alfa Aesar) CAS 81-23-2
Dehydrocholic Acid, >98.0%(T) TCI CAS 81-23-2
Dehydrocholic acid, 95%, 95% Chemat CAS 81-23-2
Dehydrocholic acid, 99.92% MedChemExpress CAS 81-23-2
Dehydrocholic acid (Standard), 98.15% MedChemExpress CAS 81-23-2
Dehydrocholic acid, min. 99 %, for biochemistry, 25 g, plastic Roth CAS 81-23-2
Dehydrocholic acid, min. 99 %, for biochemistry, 100 g, plastic Roth CAS 81-23-2