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Back ChemicalBook Home>CAS DataBase List>10421-49-5More Spectrum> HYODEOXYCHOLIC ACID SODIUM SALT(10421-49-5) IR1

HYODEOXYCHOLIC ACID SODIUM SALT(10421-49-5) IR1

Molecular FormulaC24H39NaO4

Molecular Weight414.55

InChIInChI=1/C24H40O4.Na/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2;/h14-21,25-26H,4-13H2,1-3H3,(H,27,28);/q;+1/p-1/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-;/s3

InChIKey DUYSCILLIVEITB-NQWFWYPSNA-M

Smiles[C@@]12([H])C[C@@H]([C@]3([H])C[C@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCC([O-])=O)O.[Na+] |&1:0,3,4,7,11,13,17,19,22,24,r|

in DMSO-d6



KBr disc



nujol mull



HYODEOXYCHOLIC ACID SODIUM SALT(10421-49-5) IR1 Atlas of Related Products

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