Sodium Taurodeoxycholate
CAS number: 1180-95-6
Synonyms:
Taurine, N-(3α,12α-dihydroxy-5β-cholan-24-oyl)-, monosodium salt, Taurodeoxycholic acid sodium salt, Sodium 3α
Identifiers
CAS Index Name:
Ethanesulfonic acid, 2-[[(3α,5β,12α)-3,12-dihydroxy-24-oxocholan-24-yl]amino]-, monosodium salt
Molecular formula:
C26H45NO6S.Na
Molecular weight:
522.7
Smiles:
[Na].O=C(NCCS(=O)(=O)O)CCC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(O)C12C
Isomeric Smiles:
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@](CC3)(C[C@H](O)CC4)[H])(C[C@@H]1O)[H])[H])(CC[C@@]2([C@@H](CCC(NCCS(=O)(=O)O)=O)C)[H])[H].[Na]
InChI:
InChI=1S/C26H45NO6S.Na/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3;/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-;/m1./s1
InChIKey:
InChIKey=DIBGIDJLTRRMCC-FVCKGWAHSA-N
Product information
Purity:
>98%
Storage:
Freezer
Supplied as:
Neat
Physical state:
Solid
Documentation:
Certificate of Analysis
MSDS:
Ask for MSDS
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| 65-1014-9 | Sodium Taurodeoxycholate - 100 mg | 173.00 € |