(4R)-4-[(3R,6S,10R,13R,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]pentanoic acid

Base Information Edit

Chemical Name:(4R)-4-[(3R,6S,10R,13R,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]pentanoic acid
CAS No.:83-49-8
Molecular Formula:C24H40O4
Molecular Weight:392.579
Hs Code.:29181990
Metabolomics Workbench ID:36266
Wikipedia:Hyodeoxycholic_acid
Mol file:83-49-8.mol

(4R)-4-[(3R,6S,10R,13R,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]pentanoic acid

Synonyms:3,6-dihydroxy-5alpha-cholanoic acid;hyodeoxycholic acid;hyodeoxycholic acid, (3alpha,5beta,6beta)-isomer;hyodeoxycholic acid, (3alpha,6beta)-isomer;hyodeoxycholic acid, sodium salt;hyodesoxycholic acid;murideoxycholic acid;NaHDC compound;sodium hyodeoxycholate

Suppliers and Price of (4R)-4-[(3R,6S,10R,13R,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]pentanoic acid

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
α-HyodeoxycholicAcid
100mg
$ 55.00

Sigma-Aldrich
Hyodeoxycholic acid ≥98%
5g
$ 83.70

Matrix Scientific
(4R)-4-((3R,5R,6S,10R,13R,17R)-3,6-Dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoicacid 97%
250g
$ 168.00

Matrix Scientific
(4R)-4-((3R,5R,6S,10R,13R,17R)-3,6-Dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoicacid 97%
25g
$ 29.00

Matrix Scientific
(4R)-4-((3R,5R,6S,10R,13R,17R)-3,6-Dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoicacid 97%
100g
$ 79.00

JR MediChem
Hyodeoxycholic acid 98%
20mg
$ 80.00

DC Chemicals
Hyodeoxycholic acid >98%,StandardReferencesGrade
20 mg
$ 280.00

ChemScene
Hyodeoxycholic acid >99.0%
100mg
$ 60.00

Chemenu
Hyodeoxycholic acid 95%
500g
$ 102.00

Chemenu
Hyodeoxycholic acid 95%
1000g
$ 163.00

Total 158 raw suppliers

Chemical Property of (4R)-4-[(3R,6S,10R,13R,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]pentanoic acid Edit

Chemical Property:

Appearance/Colour:White or slightly yellow powder
Vapor Pressure:0mmHg at 25°C
Melting Point:200-201 °C
Refractive Index:1.4460 (estimate)
Boiling Point:547.1 °C at 760 mmHg
PKA:4.76±0.10(Predicted)
Flash Point:298.8 °C
PSA：77.76000
Density:1.128 g/cm³
LogP:4.47790
Storage Temp.:Refrigerator
Solubility.:Solubility in methanol, very faint turbidity. Slightly soluble i
Water Solubility.:5.889mg/L(25 oC)
XLogP3:4.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:392.29265975
Heavy Atom Count:28
Complexity:605

Purity/Quality:

99%, ^*data from raw suppliers

α-HyodeoxycholicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 36/37/38-40
Safety Statements: 26-36/37/39-36-22-37

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(CCC(=O)O)C1CCC2C1(CCC3C2CC(C4C3(CCC(C4)O)C)O)C
Isomeric SMILES:C[C@H](CCC(=O)O)[C@H]1CCC2[C@@]1(CCC3C2C[C@@H](C4[C@@]3(CC[C@H](C4)O)C)O)C
Uses Protected β-Hyodeoxycholic Acid (H998105), a potential bile acid metabolite. Labelled Hyodeoxycholic Acid. Unlabelled version is isolated from pig bile. Antitumor agent It is isolated from pig bile. Antitumor agent Labelled β-Hyodeoxycholic Acid

Technology Process of (4R)-4-[(3R,6S,10R,13R,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]pentanoic acid

There total 36 articles about (4R)-4-[(3R,6S,10R,13R,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]pentanoic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 38411-84-6
glycohyodeoxycholic acid sodium salt

: 83-49-8
Hyodeoxycholic Acid

: 56-40-6,18875-39-3,25718-94-9
glycine

Guidance literature:: With ethylenediaminetetraacetic acid; chloylglycine hydrolase; 2-hydroxyethanethiol; In phosphate buffer; at 20 ℃; for 3h; pH=8;
DOI:10.1016/j.steroids.2005.10.002

Reference yield:

: Sodium; 2-[(R)-4-((3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-17-yl)-pentanoylamino]-ethanesulfonate

: 107-35-7
Tau

: 83-49-8
Hyodeoxycholic Acid

Guidance literature:: With ethylenediaminetetraacetic acid; chloylglycine hydrolase; 2-hydroxyethanethiol; In phosphate buffer; at 20 ℃; for 3h; pH=8;
DOI:10.1016/j.steroids.2005.10.002