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Merck

30968

Sodium deoxycholate monohydrate

BioUltra, ≥99.0% (NT)

Synonym(s):

3α,12α-Dihydroxy-5β-cholanic acid sodium salt, 7-Deoxycholic acid sodium salt, Desoxycholic acid sodium salt

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About This Item

Empirical Formula (Hill Notation):
C24H39NaO4 · H2O
CAS Number:
Molecular Weight:
432.57
UNSPSC Code:
12161900
NACRES:
NA.25
PubChem Substance ID:
EC Number:
206-132-7
Beilstein/REAXYS Number:
3643164
MDL number:
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description

anionic

Quality Level

product line

BioUltra

assay

≥99.0% (NT)

form

powder

optical activity

[α]20/D +44±2°, c = 2% in H2O

mol wt

average mol wt 1200-5000

aggregation number

3-12

impurities

insoluble matter, passes filter test, ≤0.5% cholic acid (TLC), ≤6.1% water

pH

7.5-9.5 (25 °C, 0.1 M in H2O)

CMC

2-6

solubility

H2O: 0.1 M at 20 °C, clear, colorless

anion traces

chloride (Cl-): ≤50 mg/kg, sulfate (SO42-): ≤200 mg/kg

cation traces

Al: ≤20 mg/kg, Ba: ≤5 mg/kg, Bi: ≤5 mg/kg, Cd: ≤5 mg/kg, Co: ≤5 mg/kg, Cr: ≤5 mg/kg, Cu: ≤5 mg/kg, Fe: ≤5 mg/kg, Li: ≤5 mg/kg, Mg: ≤20 mg/kg, Mn: ≤5 mg/kg, Mo: ≤5 mg/kg, Ni: ≤5 mg/kg, Pb: ≤5 mg/kg, Sr: ≤20 mg/kg, Zn: ≤5 mg/kg

λ

0.1 M in H2O

UV absorption

λ: 260 nm Amax: 0.10, λ: 280 nm Amax: 0.08

HLB

16

SMILES string

O.[Na+].C[C@H](CCC([O-])=O)C1CCC2C3CCC4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C

InChI

1S/C24H40O4.Na.H2O/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3;;/h14-21,25-26H,4-13H2,1-3H3,(H,27,28);;1H2/q;+1;/p-1/t14-,15-,16-,17+,18-,19+,20+,21+,23+,24-;;/m1../s1

InChI key

NDVHNZISGVSFMP-WTCAICSISA-M

General description

Sodium deoxycholate monohydrate is a lipid bile salt used in drug delivery systems.

Application

Powerful solubilization agent; used in the solubilization of estrogen synthetase from human placental microsomes.

Biochem/physiol Actions

Bile salt


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pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves



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