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Reference substances

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IUPAC name:
sodium [(3,12-dihydroxy-24-oxocholan-24-yl)amino]acetate

Inventory

EC number:
240-455-4
CAS number:
16409-34-0
CAS number:
16409-34-0

Synonyms

Molecular and structural information

Molecular formula:
C26H43NO5.Na
Molecular weight:
471.605
SMILES notation:
[Na+].C[C@H](CCC(=O)NCC(=O)[O-])[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
InChl:
InChI=1/C26H43NO5.Na/c1-15(4-9-23(30)27-14-24(31)32)19-7-8-20-18-6-5-16-12-17(28)10-11-25(16,2)21(18)13-22(29)26(19,20)3;/h15-22,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32);/q;+1/p-1
Structural formula:
Chemical structure

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