Sodium tauroursodeoxycholate

Catalog Number: BC-0866

CAS Number: 35807-85-3

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Specifications

Product Information
Molecular Formula	C₂₆H₄₄NO₆S • Na
Molecular Weight	521.69
Purity	≥98%
SMILES	C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]21C.[Na+]
InChi	InChI=1S/C26H45NO6S.Na/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29;/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17+,18-,19-,20+,21+,22+,24+,25+,26-;/m1./s1
InChi Key	IYPNVUSIMGAJFC-JUWYWQLMSA-M
Alternate Name	TUDCA 3α,7β-dihydroxy-5β-cholanoyl Taurine 2-[[(3α,5β,7β)-3,7-dihydroxy-24-oxocholan-24-yl]amino]-ethanesulfonic acid, monosodium salt

Properties
Storage Conditions	-20ºC
Shipping Conditions	Gel Pack
Solubility	>100 mg/ml DMSO, >100 mg/ml Water

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