(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;3β-Hydroxy-5α-Cholan-24-Oic Acid;Isoallolithocholic acid, 10 mM in DMSO;Cholan-24-oic acid, 3-hydroxy-, (3β,5α)-
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.

in vivo

Isoallolithocholic acid (0.03%; in diet; 7 days) enhances Treg cells in B6 mice^[1].

Animal Model:	Segmented filamentous bacteria (SFB)-colonized Jax-B6 mice^[1]
Dosage:	0.03% (w/w)
Administration:	In diet, 7 days
Result:	Was insufficient to enhance Treg percentages both at steady state and following anti-CD3 treatment alone. Significantly enhanced the Treg population in mice treated with anti-CD3 compared to control diet in combination with 0.3% (w/w) 3-oxolithocholic acid (3-oxoLCA). Reduced the number of CD45.1⁺ T effector cells.

(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

3β-Hydroxy-5α-Cholan-24-Oic Acid

Isoallolithocholic acid, 10 mM in DMSO

Isoallolithocholic acid (Synonyms: 3β-Hydroxy-5α-cholanic acid)

(R)-4-((3S,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid - [AC78177]

2276-93-9