ChemicalBook > CAS DataBase List > (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

(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

Product Name
(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
CAS No.
2276-93-9
Chemical Name
(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
Synonyms
Isoallolithocholic acid;Alloisolithocholic Acid;5α-CHOLANIC ACID-3β-OL;5a-CHOLANIC ACID-3-β-OL;EPIALLOLITHOCHOLIC ACID;5a-Cholanic Acid-3-ol-d2;5α-Cholanic Acid-3β-ol D2;Cholan-24-oic acid, 3-hydroxy-, (3β,5α)-;Isoallolithocholic Acid (5-alfa-Cholanic Acid-3-beta-ol);Alloisolithocholic Acid|||AILCA|||3β-Hydroxy-5α-cholanic acid
CBNumber
CB31236030
Molecular Formula
C24H40O3
Formula Weight
376.57
MOL File
2276-93-9.mol
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(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 Property

Melting point:
>170°C (dec.)
Boiling point:
511.0±23.0 °C(Predicted)
Density 
1.073±0.06 g/cm3(Predicted)
storage temp. 
-20°C, Inert atmosphere
solubility 
Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
form 
Solid
pka
4.76±0.10(Predicted)
color 
White to Off-White
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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

AK Scientific
Product number
6556CA
Product name
Isoallolithocholicacid
Packaging
25mg
Price
$429
Updated
2021/12/16
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(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 Chemical Properties,Usage,Production

Uses

Isoallolithocholic Acid is used as a steroid compound as T regulatory lymphocyte modulators and uses for treatment of inflammatory or autoimmune disorders.

Definition

ChEBI: Isoallolithocholic acid is a bile acid.

(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 Preparation Products And Raw materials

Raw materials

Preparation Products

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(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 Suppliers

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2276-93-9, (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 acidRelated Search:

Glycoursodeoxycholic Acid Tauroursodeoxycholic acid URSODEOXYCHOLIC-2,2,4,4-D4 ACID TAUROLITHOCHOLIC ACID SODIUM SALT GLYCOURSODEOXYCHOLIC-2,2,4,4-D4 ACID (4R)-4-[(3S,5S,7S,8S,9S,10R,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]pentanoic acid Taurolithocholic-d4 Acid RUDATBOHQWOJDD-ZAYXGXDFSA-N 3alpha-Hydroxy-7-oxo-5beta-cholanic Acid

  • Isoallolithocholic acid
  • 5a-Cholanic Acid-3-ol-d2
  • Isoallolithocholic Acid (5-alfa-Cholanic Acid-3-beta-ol)
  • Alloisolithocholic Acid
  • (R)-4-((3S,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
  • 5a-CHOLANIC ACID-3-β-OL
  • 5α-Cholanic Acid-3β-ol D2
  • EPIALLOLITHOCHOLIC ACID
  • Cholan-24-oic acid, 3-hydroxy-, (3β,5α)-
  • 5α-CHOLANIC ACID-3β-OL
  • Alloisolithocholic Acid|||AILCA|||3β-Hydroxy-5α-cholanic acid
  • (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
  • 2276-93-9