CAS 81-25-4 Cholic acid molecular structure

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CAS RN: 81-25-4

Cholic acid

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9 package records9 with current stock5 grade groups

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Batch No.	Package	Availability	Inquiry
Batchno.20260625	100g	In stock	Inquiry
Batchno.20251207	250g	In stock	Inquiry
Batchno.20250601	25g	In stock	Inquiry
Batchno.20250330	500g	In stock	Inquiry
Batchno.20250829	5g	In stock	Inquiry

Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20260228	1ml	In stock		Inquiry

Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20260509	5g / 25g / 100g / 500g / 2.5kg / 10kg	Confirm by inquiry	Shanghai, Shandong, Guangdong, Chongqing, Hebei	Inquiry

Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20250824	100mg	In stock	Shanghai, Shandong, Chongqing	Inquiry

Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20260517	20mg	In stock		Inquiry

Product code: SSC-189594

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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

Pack sizes on record: 5g, 100g, 25g, 10g, 500g, 1000g
Available purity: 98.00-102.00%
Inventory rows with stock: 4
Bulk packaging: confirmed by inquiry

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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 81-25-4
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
5g	98.00-102.00%	5 In Stock	Beijing	Inquiry
100g	98.00-102.00%	3 In Stock	Hong Kong	Inquiry
25g	98.00-102.00%	2 In Stock	Beijing	Inquiry
10g	98.00-102.00%	1 In Stock	Shenzhen	Inquiry
500g	98.00-102.00%	0 Out of Stock	Beijing	Inquiry
1000g	98.00-102.00%	0 Out of Stock	Hong Kong	Inquiry

81-25-4 / (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

Standard CAS: 81-25-4 Multi CAS: Yes

Basic Information Physical Properties Computed Properties

Basic Information

CAS

81-25-4

Multi CAS

Yes

Molecular Formula

C24H40O5

Molecular Weight

408.600000

Exact Mass

408.287574

InChI

InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1

InChIKey

BHQCQFFYRZLCQQ-OELDTZBJSA-N

Physical Properties

Melting Point

198 °C (anhydrous) Crystals from alcohol + water. MP: 155-156 °C /Cholic acid methyl ester/ Crystals from ethyl acetate + petroleum ether. MP: 162-163 °C /Cholic acid ethyl ester/ 197 - 201 °C

Physical Description

Solid; [HSDB] White powder; Solid

Appearance

Plates from dilute acetic acid Crystals

State

Solid

Computed Properties

Structural Parameters

Heavy atom count

Fraction Csp3

0.96

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

110.04

TPSA

97.99

LogP / Solubility

WLOGP

3.45

MLOGP

3.06

XLogP3

3.6

Consensus LogP

3.37

Log S (ESOL)

-4.28

Class (ESOL)

Slightly soluble

Log S (Ali)

-5.4

Class (Ali)

Slightly soluble

Log S (SILICOS-IT)

-5.66

Class (SILICOS-IT)

Slightly soluble

ADME

GI absorption

High

BBB permeant

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

CYP2D6 inhibitor

CYP3A4 inhibitor

Yes

Log Kp (skin permeation)

-2.76

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Yes

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Leadlikeness

Synthetic Accessibility

8.5

Applications of CAS 81-25-4

This compound is commonly used in analytical chemistry and reference standard applications, general chemistry research and laboratory applications. Starshine Chemical supplies CAS 81-25-4 for R&D and pilot-scale use, with flexible pack sizes and purity grades available.

Physical & Chemical Properties

IUPAC Name

(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

Safety Information (GHS)

Pictogram(s): GHS07. Signal word: Warning.

H312 (40%): Harmful in contact with skin [Warning Acute toxicity, dermal]
H315 (73.3%): Causes skin irritation [Warning Skin corrosion/irritation]
H317 (40%): May cause an allergic skin reaction [Warning Sensitization, Skin]
H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

Precautionary statements: P261, P264, P264+P265, P272, P280, P302+P352, P305+P351+P338, P317, P321, P332+P317, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Request the SDS (Safety Data Sheet) for full hazard and safety documentation.

Storage & Handling

Storage: Keep the container tightly closed in a cool, dry and well-ventilated place. For detailed hazard, storage and transport information, request the SDS (Safety Data Sheet) with your inquiry.

Quotation & Packaging

Prices are confirmed by inquiry. Request a quote for current pricing, minimum order quantity (MOQ) and lead time. The pack sizes listed on this page are reference options; custom pack sizes and bulk quantities are available on request.

Quality & Compliance

Specifications and purity shown on this page are based on batch records. A Certificate of Analysis (COA) is available on request. For research and further manufacturing use only — not for direct human or therapeutic use.