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Dehydrocholate sodium

Also known as Sodium dehydrocholate, Carachol, Biliron

CAS 145-41-5Formula C24H33NaO5Molar mass 424.51 g/molEC 205-652-1
Dehydrocholate sodium chemical structure, C24H33NaO5, CAS 145-41-5
2D chemical structure

Key facts

What buyers check first

CAS number
145-41-5
Formula
C24H33NaO5
Molar mass
424.51 g/mol
EC number
205-652-1
HS code
291830
Category
Steroids and sterols

What is Dehydrocholate sodium?

Plain description, key identifiers and synonyms

Sodium Dehydrocholate is a bile acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
sodium (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]pentanoate
CAS number
145-41-5 CAS number cross-checked
EC number
205-652-1
Molecular formula
C24H33NaO5
UNII
W4193719XR
MDL number
MFCD00066411
InChIKey
FKJIJBSJQSMPTI-CAOXKPNISA-M
InChI
InChI=1S/C24H34O5.Na/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;/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,16-,17+,18+,22+,23+,24-;/m1./s1
Canonical SMILES
CC(CCC(=O)[O-])C1CCC2C3C(=O)CC4CC(=O)CCC4(C)C3CC(=O)C12C.[Na+]
Isomeric SMILES
C[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.[Na+]

Synonyms

  • Sodium dehydrocholate
  • Carachol
  • Biliron
  • Natriumdehydrocholat
  • Biliton
  • Dycholium
  • Suprachol
  • Dilabil sodium
  • Dehydrocholate de sodium
  • Dehidrocolato sodico
  • Natrii dehydrocholas
  • Decholin sodium salt
  • Sodium 3,7,12-trioxo-5beta-cholan-24-oate
  • Sodium 3,7,12-triketocholanate
  • Triceto 3-7-12 cholanate de Na
  • Sodium 3,7,12-trioxo-5-beta-cholanate
  • Sodium 3,7,12-trioxo-5-beta-cholan-24-oate
  • Cholan-24-oic acid, 3,7,12-trioxo-, sodium salt, (5beta)-
  • 5-beta-Cholan-24-oic acid, 3,7,12-trioxo-, monosodium salt
  • Cholan-24-oic acid, 3,7,12-trioxo-, sodium salt, (5-beta)-
  • Dehydrocholate sodium (USP)
  • 5-beta-Cholan-24-oic acid, 3,7,12-trioxo-, sodium salt
  • Natrii dehydrocholas (INN-Latin)
  • Dehidrocolato sodico (INN-Spanish)
  • Dehydrocholate de sodium (INN-French)
Show all 28 synonyms
  • Dehydrocholate (sodium)
  • Decholin Sodium
  • Dehydrocholic acid sodium salt

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
424.51 g/molcalc.
Exact mass
424.2226 Dacalc.
LogP (octanol/water)
-0.26calc.
Topological polar surface area
91.34 ร…ยฒcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
4calc.
Heavy atoms
30calc.
Rings
4calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.83calc.
Formal charge
0calc.
Stereocentres
8calc.
Components
2calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1CCC2C(C1)CC(=O)C1C3CCCC3C(=O)CC21

O=C1CCC2C(C1)CC(=O)C1C3CCCC3C(=O)CC21

4 rings, 20 atoms.

19 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Dehydrocholate sodium suppliers

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Dehydrocholate sodium price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

United States

  • TSCA inventory (USA)
    Status: Inactive in US commerce

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Dehydrocholate sodium is traded under.

HS 2918.30Indicative HS code

Carboxylic acids with aldehyde or ketone function but without other oxygen functionโ€ฆ

World exports in 2024
$813M
โˆ’39.8% vs 2023, imports $1.23B
2019 to 2024
Top exporters
  1. China43.3%
  2. India * partner reported10.4%
  3. United States6.8%
Top importers
  1. Singapore33.1%
  2. Germany7.2%
  3. Japan6.9%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Dehydrocholate sodium is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Dehydrocholate sodium, based on the data on this page

What is Dehydrocholate sodium?

Sodium Dehydrocholate is a bile acid.

What is the CAS number of Dehydrocholate sodium?

The CAS registry number of Dehydrocholate sodium is 145-41-5.

What is the molecular formula and weight of Dehydrocholate sodium?

The molecular formula of Dehydrocholate sodium is C24H33NaO5 and its molar mass is 424.51 g/mol.

Is Dehydrocholate sodium hazardous?

No GHS hazard classification for Dehydrocholate sodium is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Dehydrocholate sodium?

Dehydrocholate sodium is usually classified under HS code 291830 (Carboxylic acids with aldehyde or ketone function but without other oxygen functionโ€ฆ). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Dehydrocholate sodium?

CompoundList lists 7 suppliers of Dehydrocholate sodium in China, Germany, France, Hong Kong and 2 more. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Dehydrocholate sodium?

Suppliers quote Dehydrocholate sodium on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Dehydrocholate sodium

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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